N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide

C13H11ClN2O2 — CID 767774

IUPACN-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cccnc1
InChIInChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(14)7-11(12)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17)
InChIKeyYKUDQCNVDCUVFC-UHFFFAOYSA-N
MW262.70 g/mol
LogP3.00
Rot. Bonds3

About N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide

N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide (PubChem CID 767774) has the molecular formula C13H11ClN2O2 and a molecular weight of 262.70 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
PubChem CID767774
Molecular FormulaC13H11ClN2O2
Molecular Weight262.70 g/mol
Exact Mass262.05
IUPAC NameN-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(Cl)cc1NC(=O)c1cccnc1
InChIInChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(14)7-11(12)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17)
InChIKeyYKUDQCNVDCUVFC-UHFFFAOYSA-N
XLogP3.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.70
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide (CID 767774) is N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide is COc1ccc(Cl)cc1NC(=O)c1cccnc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
The InChIKey is YKUDQCNVDCUVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O2/c1-18-12-5-4-10(14)7-11(12)16-13(17)9-3-2-6-15-8-9/h2-8H,1H3,(H,16,17).
What are the key properties of N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide?
N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide has a molecular weight of 262.70 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 767774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).