TL;DR: N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine (CAS 1005270-23-4) is a chemical compound with molecular formula C16H29N and molecular weight 235.23 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine
Also Known As: N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine, N-((2,4,6-trimethylcyclohex-3-en-1-yl)methyl)cyclohexanamine, N-[(2,4,6-trimethyl-1-cyclohex-3-enyl)methyl]cyclohexanamine
| Molecular Formula | C16H29N |
| Molecular Weight | 235.23 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 235.23 Da |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
| SMILES | CC1CC(=CC(C1CNC2CCCCC2)C)C |
| InChIKey | SCIDAAFYEQBFPN-UHFFFAOYSA-N |
The XLogP value of 4.1 indicates that N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine is 1005270-23-4.
The molecular formula of N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine is C16H29N.
The molecular weight of N-[(2,4,6-trimethylcyclohex-3-en-1-yl)methyl]cyclohexanamine is 235.23 g/mol.
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