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N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide structure
Fine Chemical

N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide

TL;DR: N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide (CAS 852902-75-1) is a chemical compound with molecular formula C18H19ClN4O and molecular weight 342.12473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide

Also Known As: N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide, N-(3-chloro-4-cyano-phenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide, N-(3-chloro-4-cyanophenyl)-2-[2-(1-methyl-1H-pyrrol-2-yl)pyrrolidin-1-yl]acetamide

CAS Number
852902-75-1
Molecular Formula
C18H19ClN4O
Molecular Weight
342.12473 g/mol
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Technical Specifications

Molecular FormulaC18H19ClN4O
Molecular Weight342.12473 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)61.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors3
Rotatable Bonds4
Exact Mass342.12473 Da
Heavy Atoms24
Complexity504.0
SMILESCN1C=CC=C1C2CCCN2CC(=O)NC3=CC(=C(C=C3)C#N)Cl
InChIKeyPHSDOAAWEVVCBG-UHFFFAOYSA-N

Product Description

Applications: N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide (CAS 852902-75-1) is a fine chemical with the molecular formula C18H19ClN4O and a molecular weight of 342.12 g/mol. Synonyms include N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide and N-(3-chloro-4-cyano-phenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide.

Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide

XLogP
2.3
TPSA (Topological Polar Surface Area)
61.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
24
Complexity
504.0
Exact Mass
342.12473
Monoisotopic Mass
342.12473
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide. The TPSA of 61.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide. Following Lipinski's Rule of Five, N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

The CAS number of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide is 852902-75-1.

What is the molecular formula of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

The molecular formula of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide is C18H19ClN4O.

What is the molecular weight of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

The molecular weight of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide is 342.12473 g/mol.

What are the applications of N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale),...

Where can I buy N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

You can request a quote for N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide?

Yes, CoreyChem provides custom synthesis services for N-(3-chloro-4-cyanophenyl)-2-[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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