Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-
TL;DR: Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- (CAS 220436-11-3) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-pyrrolidin-1-ylprop-1-ynyl)cyclohexan-1-ol
Also Known As: ZERO/003151, BAS 02988604, 1-(3-pyrrolidin-1-ylprop-1-ynyl)cyclohexan-1-ol, 1-(3-pyrrolidin-1-ylprop-1-ynyl)cyclohexanol, 1-(3-pyrrolidinylprop-1-ynyl)cyclohexan-1-ol
| Molecular Formula | C13H21NO |
|---|---|
| Molecular Weight | 207.16 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.16231 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 220436-11-3 |
|---|---|
| SMILES | C1CCC(CC1)(C#CCN2CCCC2)O |
| InChIKey | KGFWEMXZEJKCKM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- (CAS 220436-11-3), with molecular formula C13H21NO and molecular weight 207.16 g/mol. IUPAC: 1-(3-pyrrolidin-1-ylprop-1-ynyl)cyclohexan-1-ol.
Chemical Property Profile of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-
Property Insights of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-. With a topological polar surface area (TPSA) of 23.5 Ų, Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- 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 Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-?
The CAS number of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- is 220436-11-3.
What is the molecular formula of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-?
The molecular formula of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- is C13H21NO.
What is the molecular weight of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-?
The molecular weight of Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- is 207.16 g/mol.
Where can I buy Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-?
You can request a quote for Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanol, 1-[3-(1-pyrrolidinyl)-1-propynyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.