1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate
TL;DR: 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate (CAS 32550-21-3) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylpyrrolidin-3-yl) N-(2,6-dimethylphenyl)carbamate
Also Known As: N- carbamicacid1-methyl-3-pyrrolidinylester, N-Methyl-3-pyrrodidinyl 2,6-dimethylcarbanilate, 2,6-Dimethylcarbanilic acid, N-methyl-3-pyrrolidinyl ester, (1-methylpyrrolidin-3-yl) N-(2,6-dimethylphenyl)carbamate, CARBANILIC ACID, 2,6-DIMETHYL-, N-METHYL-3-PYRROLIDINYL ESTER
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 32550-21-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)OC2CCN(C2)C |
| InChIKey | HBTVSGZSFGQRPQ-UHFFFAOYSA-N |
Product Overview
1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate (CAS 32550-21-3), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: (1-methylpyrrolidin-3-yl) N-(2,6-dimethylphenyl)carbamate.
Chemical Property Profile of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate
Property Insights of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate. With a topological polar surface area (TPSA) of 41.6 Ų, 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)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-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate?
The CAS number of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate is 32550-21-3.
What is the molecular formula of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate?
The molecular formula of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate is C14H20N2O2.
What is the molecular weight of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate?
The molecular weight of 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate is 248.15 g/mol.
Where can I buy 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate?
You can request a quote for 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylpyrrolidin-3-yl hydrogen (2,6-dimethylphenyl)carbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.