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N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide
TL;DR: N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide (CAS 720663-80-9) is a chemical compound with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide
Also Known As: N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide, Maybridge2_000042, N-(4-Cyanobenzyl)morpholine-4-carboxamide, IDI1_001082, JGG
| Molecular Formula | C13H15N3O2 |
|---|---|
| Molecular Weight | 245.12 g/mol |
| LogP | 1.10008 |
| Topological Polar Surface Area | 65.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.11642 |
| Heavy Atoms | 18 |
| Complexity | 444.29932 |
Chemical Identifiers
| CAS Number | 720663-80-9 |
|---|---|
| SMILES | C1COCCN1C(=O)NCC2=CC=C(C=C2)C#N |
Product Overview
N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide (CAS 720663-80-9), with molecular formula C13H15N3O2 and molecular weight 245.12 g/mol. IUPAC: N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide.
Chemical Property Profile of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide
Property Insights of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide
The XLogP value of 1.10008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide. The TPSA of 65.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide. Following Lipinski's Rule of Five, N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide has 1 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 N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide?
The CAS number of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide is 720663-80-9.
What is the molecular formula of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide?
The molecular formula of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide is C13H15N3O2.
What is the molecular weight of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide?
The molecular weight of N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide is 245.12 g/mol.
Where can I buy N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide?
You can request a quote for N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-cyanophenyl)methyl]morpholine-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.