Nicotinonitrile, 1,4-dihydro-1-pentyl-
TL;DR: Nicotinonitrile, 1,4-dihydro-1-pentyl- (CAS 19424-19-2) is a chemical compound with molecular formula C11H16N2 and molecular weight 176.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pentyl-4H-pyridine-3-carbonitrile
Also Known As: Nicotinonitrile, 1,4-dihydro-1-pentyl-, 1-pentyl-4H-pyridine-3-carbonitrile, 1,4-Dihydro-1-pentylpyridine-3-carbonitrile, 1-pentyl-1,4-dihydropyridine-3-carbonitrile, 1-Pentyl-1,4-dihydro-3-pyridinecarbonitrile #
| Molecular Formula | C11H16N2 |
|---|---|
| Molecular Weight | 176.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 176.13135 |
| Heavy Atoms | 13 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 19424-19-2 |
|---|---|
| SMILES | CCCCCN1C=CCC(=C1)C#N |
| InChIKey | PUUAUUWQCDMOLK-UHFFFAOYSA-N |
Product Overview
Nicotinonitrile, 1,4-dihydro-1-pentyl- (CAS 19424-19-2), with molecular formula C11H16N2 and molecular weight 176.13 g/mol. IUPAC: 1-pentyl-4H-pyridine-3-carbonitrile.
Chemical Property Profile of Nicotinonitrile, 1,4-dihydro-1-pentyl-
Property Insights of Nicotinonitrile, 1,4-dihydro-1-pentyl-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nicotinonitrile, 1,4-dihydro-1-pentyl-. With a topological polar surface area (TPSA) of 27.0 Ų, Nicotinonitrile, 1,4-dihydro-1-pentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nicotinonitrile, 1,4-dihydro-1-pentyl- has 0 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 Nicotinonitrile, 1,4-dihydro-1-pentyl-?
The CAS number of Nicotinonitrile, 1,4-dihydro-1-pentyl- is 19424-19-2.
What is the molecular formula of Nicotinonitrile, 1,4-dihydro-1-pentyl-?
The molecular formula of Nicotinonitrile, 1,4-dihydro-1-pentyl- is C11H16N2.
What is the molecular weight of Nicotinonitrile, 1,4-dihydro-1-pentyl-?
The molecular weight of Nicotinonitrile, 1,4-dihydro-1-pentyl- is 176.13 g/mol.
Where can I buy Nicotinonitrile, 1,4-dihydro-1-pentyl-?
You can request a quote for Nicotinonitrile, 1,4-dihydro-1-pentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nicotinonitrile, 1,4-dihydro-1-pentyl-?
Yes, KEHONG BIO provides custom synthesis services for Nicotinonitrile, 1,4-dihydro-1-pentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.