(1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate
TL;DR: (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate (CAS 20930-80-7) is a chemical compound with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpyrrolidin-3-yl)methyl N-(2-methylphenyl)carbamate
Also Known As: o-Methylcarbanilic acid (1-ethyl-3-pyrrolidinyl)methyl ester, (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate, (1-ethylpyrrolidin-3-yl)methyl N-(2-methylphenyl)carbamate, CARBANILIC ACID, o-METHYL-, (1-ETHYL-3-PYRROLIDINYL)METHYL ESTER, RefChem:1049255
| Molecular Formula | C15H22N2O2 |
|---|---|
| Molecular Weight | 262.17 g/mol |
| LogP | 2.88532 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.16812 |
| Heavy Atoms | 19 |
| Complexity | 433.9087 |
Chemical Identifiers
| CAS Number | 20930-80-7 |
|---|---|
| SMILES | CCN1CCC(C1)COC(=O)NC2=CC=CC=C2C |
Product Overview
(1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate (CAS 20930-80-7), with molecular formula C15H22N2O2 and molecular weight 262.17 g/mol. IUPAC: (1-ethylpyrrolidin-3-yl)methyl N-(2-methylphenyl)carbamate.
Chemical Property Profile of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate
Property Insights of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate
The XLogP value of 2.88532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate. With a topological polar surface area (TPSA) of 41.57 Ų, (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate 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
Frequently Asked Questions
What is the CAS number of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate?
The CAS number of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate is 20930-80-7.
What is the molecular formula of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate?
The molecular formula of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate is C15H22N2O2.
What is the molecular weight of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate?
The molecular weight of (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate is 262.17 g/mol.
Where can I buy (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate?
You can request a quote for (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate?
Yes, KEHONG BIO provides custom synthesis services for (1-Ethylpyrrolidin-3-yl)methyl hydrogen (2-methylphenyl)carbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.