N,1-二甲基-N-(丙-2-炔-1-基)己胺
TL;DR: N,1-二甲基-N-(丙-2-炔-1-基)己胺 (CAS 7665-88-5) is a chemical compound with molecular formula C11H21N and molecular weight 167.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,1-二甲基-N-(丙-2-炔-1-基)己胺
N-methyl-N-prop-2-ynylheptan-2-amine
Also Known As: N,1-Dimethyl-N-2-propynylhexylamine, N-methyl-N-prop-2-ynylheptan-2-amine, n-(2-heptyl)-n-methylpropargylamine, HEXYLAMINE, N,1-DIMETHYL-N-2-PROPYNYL-, 2-Heptanamine, N-methyl-N-2-propyn-1-yl-
| Molecular Formula | C11H21N |
|---|---|
| Molecular Weight | 167.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 167.1674 |
| Heavy Atoms | 12 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 7665-88-5 |
|---|---|
| SMILES | CCCCCC(C)N(C)CC#C |
| InChIKey | VNEMYKBWMWWZIU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,1-二甲基-N-(丙-2-炔-1-基)己胺 (CAS 7665-88-5), with molecular formula C11H21N and molecular weight 167.17 g/mol. IUPAC: N-methyl-N-prop-2-ynylheptan-2-amine.
Chemical Property Profile of N,1-二甲基-N-(丙-2-炔-1-基)己胺
Property Insights of N,1-二甲基-N-(丙-2-炔-1-基)己胺
The XLogP value of 3.1 indicates that N,1-二甲基-N-2-丙炔基己胺 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,1-二甲基-N-(丙-2-炔-1-基)己胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,1-二甲基-N-2-丙炔基己胺 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,1-二甲基-N-2-丙炔基己胺?
The CAS number of N,1-二甲基-N-2-丙炔基己胺 is 7665-88-5.
What is the molecular formula of N,1-二甲基-N-2-丙炔基己胺?
The molecular formula of N,1-二甲基-N-2-丙炔基己胺 is C11H21N.
What is the molecular weight of N,1-二甲基-N-2-丙炔基己胺?
The molecular weight of N,1-二甲基-N-2-丙炔基己胺 is 167.17 g/mol.
Where can I buy N,1-二甲基-N-2-丙炔基己胺?
You can request a quote for N,1-二甲基-N-2-丙炔基己胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,1-二甲基-N-2-丙炔基己胺?
Yes, KEHONG BIO provides custom synthesis services for N,1-二甲基-N-2-丙炔基己胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.