Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-
TL;DR: Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- (CAS 102395-79-9) is a chemical compound with molecular formula C18H25N3O2 and molecular weight 315.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-hydroxypropan-2-yl)-1-(1H-indol-3-ylmethyl)piperidine-4-carboxamide
Also Known As: NIOSH/NS5030000, L-2-(1-Skatyl-4-isonipecotamido)-1-propanol, L-N-(1-Hydroxy-2-propyl)-1-(3-indolylmethyl)isonipecotamide, 4-22-00-04313 (Beilstein Handbook Reference), N-(1-hydroxypropan-2-yl)-1-(1H-indol-3-ylmethyl)piperidine-4-carboxamide
| Molecular Formula | C18H25N3O2 |
|---|---|
| Molecular Weight | 315.19 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.19467 |
| Heavy Atoms | 23 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 102395-79-9 |
|---|---|
| SMILES | CC(CO)NC(=O)C1CCN(CC1)CC2=CNC3=CC=CC=C32 |
| InChIKey | MINFLCSDCVZVKX-UHFFFAOYSA-N |
Product Overview
Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- (CAS 102395-79-9), with molecular formula C18H25N3O2 and molecular weight 315.19 g/mol. IUPAC: N-(1-hydroxypropan-2-yl)-1-(1H-indol-3-ylmethyl)piperidine-4-carboxamide.
Chemical Property Profile of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-
Property Insights of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-. Following Lipinski's Rule of Five, Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- has 3 hydrogen bond donor(s) and 3 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 Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-?
The CAS number of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- is 102395-79-9.
What is the molecular formula of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-?
The molecular formula of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- is C18H25N3O2.
What is the molecular weight of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-?
The molecular weight of Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- is 315.19 g/mol.
Where can I buy Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-?
You can request a quote for Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Isonipecotamide, N-(2-hydroxy-1-methylethyl)-1-(3-indolylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.