N,N-二烯丙基环己胺
TL;DR: N,N-二烯丙基环己胺 (CAS 54391-01-4) is a chemical compound with molecular formula C12H21N and molecular weight 179.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-二烯丙基环己胺
N,N-bis(prop-2-enyl)cyclohexanamine
Also Known As: Diallylcyclohexylamine, N,N-Diallylcyclohexylamine, Cyclohexanamine, N,N-di-2-propenyl-, N,N-di(prop-2-en-1-yl)cyclohexanamine, N,N-di-2-propenylcyclohexylamine
| Molecular Formula | C12H21N |
|---|---|
| Molecular Weight | 179.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 179.1674 |
| Heavy Atoms | 13 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 54391-01-4 |
|---|---|
| SMILES | C=CCN(CC=C)C1CCCCC1 |
| InChIKey | OQPJPTHRWIALLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-二烯丙基环己胺 (CAS 54391-01-4), with molecular formula C12H21N and molecular weight 179.17 g/mol. IUPAC: N,N-bis(prop-2-enyl)cyclohexanamine.
Chemical Property Profile of N,N-二烯丙基环己胺
Property Insights of N,N-二烯丙基环己胺
The XLogP value of 3.4 indicates that N,N-二烯丙基环己胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-二烯丙基环己胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-二烯丙基环己胺 has 0 hydrogen bond donor(s) and 1 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 N,N-二烯丙基环己胺?
The CAS number of N,N-二烯丙基环己胺 is 54391-01-4.
What is the molecular formula of N,N-二烯丙基环己胺?
The molecular formula of N,N-二烯丙基环己胺 is C12H21N.
What is the molecular weight of N,N-二烯丙基环己胺?
The molecular weight of N,N-二烯丙基环己胺 is 179.17 g/mol.
Where can I buy N,N-二烯丙基环己胺?
You can request a quote for N,N-二烯丙基环己胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-二烯丙基环己胺?
Yes, KEHONG BIO provides custom synthesis services for N,N-二烯丙基环己胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.