TL;DR: Cyclohexanecarbonitrile, 1-(cyclohexylamino)- (CAS 6623-11-6) is a chemical compound with molecular formula C13H22N2 and molecular weight 206.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(cyclohexylamino)cyclohexane-1-carbonitrile
Also Known As: 1-(Cyclohexylamino)cyclohexanecarbonitrile, Maybridge1_003681, 1-(cyclohexylamino)cyclohexane-1-carbonitrile, KST-1A9471, Cyclohexanecarbonitrile, 1-(cyclohexylamino)-
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H22N2 |
| Molecular Weight | 206.1783 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.1783 Da |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
| SMILES | C1CCC(CC1)NC2(CCCCC2)C#N |
| InChIKey | OUAURGNVVSZCEB-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Cyclohexanecarbonitrile, 1-(cyclohexylamino)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.8 Ų, Cyclohexanecarbonitrile, 1-(cyclohexylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanecarbonitrile, 1-(cyclohexylamino)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Cyclohexanecarbonitrile, 1-(cyclohexylamino)- is 6623-11-6.
The molecular formula of Cyclohexanecarbonitrile, 1-(cyclohexylamino)- is C13H22N2.
The molecular weight of Cyclohexanecarbonitrile, 1-(cyclohexylamino)- is 206.1783 g/mol.
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