1-(Methylamino)cyclohexane-1-carbonitrile
TL;DR: 1-(Methylamino)cyclohexane-1-carbonitrile (CAS 6289-40-3) is a chemical compound with molecular formula C8H14N2 and molecular weight 138.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(methylamino)cyclohexane-1-carbonitrile
Also Known As: 1-(Methylamino)cyclohexanecarbonitrile, 1-(methylamino)cyclohexane-1-carbonitrile, 1- -cyclohexanecarbonitril, 1-(methylamino)-cyclohexanecarbonitril, Cyclohexanecarbonitrile, 1-(methylamino)-
| Molecular Formula | C8H14N2 |
|---|---|
| Molecular Weight | 138.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 138.11569 |
| Heavy Atoms | 10 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 6289-40-3 |
|---|---|
| SMILES | CNC1(CCCCC1)C#N |
| InChIKey | DSMAHJDZYJDGTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Methylamino)cyclohexane-1-carbonitrile (CAS 6289-40-3), with molecular formula C8H14N2 and molecular weight 138.12 g/mol. IUPAC: 1-(methylamino)cyclohexane-1-carbonitrile.
Chemical Property Profile of 1-(Methylamino)cyclohexane-1-carbonitrile
Property Insights of 1-(Methylamino)cyclohexane-1-carbonitrile
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylamino)cyclohexane-1-carbonitrile. With a topological polar surface area (TPSA) of 35.8 Ų, 1-(Methylamino)cyclohexane-1-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylamino)cyclohexane-1-carbonitrile has 1 hydrogen bond donor(s) and 2 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-(Methylamino)cyclohexane-1-carbonitrile?
The CAS number of 1-(Methylamino)cyclohexane-1-carbonitrile is 6289-40-3.
What is the molecular formula of 1-(Methylamino)cyclohexane-1-carbonitrile?
The molecular formula of 1-(Methylamino)cyclohexane-1-carbonitrile is C8H14N2.
What is the molecular weight of 1-(Methylamino)cyclohexane-1-carbonitrile?
The molecular weight of 1-(Methylamino)cyclohexane-1-carbonitrile is 138.12 g/mol.
Where can I buy 1-(Methylamino)cyclohexane-1-carbonitrile?
You can request a quote for 1-(Methylamino)cyclohexane-1-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylamino)cyclohexane-1-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylamino)cyclohexane-1-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.