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2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- structure
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2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-

TL;DR: 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- (CAS 112483-21-3) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[4-(azetidin-1-yl)but-2-ynyl]-5-methylpyrrolidin-2-one

Also Known As: 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-, 1-[4-(azetidin-1-yl)but-2-ynyl]-5-methylpyrrolidin-2-one, 1-[4-(Azetidin-1-yl)-2-butynyl]-5-methylpyrrolidin-2-one, 1-[4-(azetidin-1-yl)but-2-ynyl]-5-methyl-pyrrolidin-2-one, 1-[4-(AZETIDIN-1-YL)BUT-2-YN-1-YL]-5-METHYLPYRROLIDIN-2-ONE

CAS Number
112483-21-3
Molecular Formula
C12H18N2O
Molecular Weight
206.1419 g/mol
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Technical Specifications

Molecular FormulaC12H18N2O
Molecular Weight206.1419 g/mol
XLogP0.4
Topological Polar Surface Area (TPSA)23.6 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass206.1419 Da
Heavy Atoms15
Complexity308.0
SMILESCC1CCC(=O)N1CC#CCN2CCC2
InChIKeyRMHKTTNQONQQRB-UHFFFAOYSA-N

Chemical Property Profile of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-

XLogP
0.4
TPSA (Topological Polar Surface Area)
23.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
15
Complexity
308.0
Exact Mass
206.1419
Monoisotopic Mass
206.1419
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 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-

The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-. With a topological polar surface area (TPSA) of 23.6 Ų, 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-?

The CAS number of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- is 112483-21-3.

What is the molecular formula of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-?

The molecular formula of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- is C12H18N2O.

What is the molecular weight of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-?

The molecular weight of 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- is 206.1419 g/mol.

Where can I buy 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-?

You can request a quote for 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl-?

Yes, CoreyChem provides custom synthesis services for 2-Pyrrolidinone, 1-[4-(1-azetidinyl)-2-butyn-1-yl]-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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