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[(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate structure
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[(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate

TL;DR: [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate (CAS 1209125-69-8) is a chemical compound with molecular formula C19H19N3O3 and molecular weight 337.14264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate

Also Known As: [(1-cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate|[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-methylquinoline-4-carboxylate|EN300-26687222|Z16536804

CAS Number
1209125-69-8
Molecular Formula
C19H19N3O3
Molecular Weight
337.14264 g/mol
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Technical Specifications

Molecular FormulaC19H19N3O3
Molecular Weight337.14264 g/mol
XLogP2.6
Topological Polar Surface Area (TPSA)92.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds5
Exact Mass337.14264 Da
Heavy Atoms25
Complexity562.0
SMILESCC1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC3(CCCC3)C#N
InChIKeyDFJZKHYBGXIRJF-UHFFFAOYSA-N

Chemical Property Profile of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate

XLogP
2.6
TPSA (Topological Polar Surface Area)
92.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
5
Heavy Atoms
25
Complexity
562.0
Exact Mass
337.14264
Monoisotopic Mass
337.14264
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 [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate

The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate. The TPSA of 92.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate. Following Lipinski's Rule of Five, [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate?

The CAS number of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate is 1209125-69-8.

What is the molecular formula of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate?

The molecular formula of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate is C19H19N3O3.

What is the molecular weight of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate?

The molecular weight of [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate is 337.14264 g/mol.

Where can I buy [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate?

You can request a quote for [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate?

Yes, CoreyChem provides custom synthesis services for [(1-Cyanocyclopentyl)carbamoyl]methyl 2-methylquinoline-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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