N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide

C15H15ClN2O2 — CID 110782938

IUPACN-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCOc1c(C)cc(Cl)cc1CNC(=O)c1cccnc1
InChIInChI=1S/C15H15ClN2O2/c1-10-6-13(16)7-12(14(10)20-2)9-18-15(19)11-4-3-5-17-8-11/h3-8H,9H2,1-2H3,(H,18,19)
InChIKeyJHDHFTLHHPYKFU-UHFFFAOYSA-N
MW290.75 g/mol
LogP2.98
Rot. Bonds4

About N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide

N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide (PubChem CID 110782938) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide
PubChem CID110782938
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide
SMILESCOc1c(C)cc(Cl)cc1CNC(=O)c1cccnc1
InChIInChI=1S/C15H15ClN2O2/c1-10-6-13(16)7-12(14(10)20-2)9-18-15(19)11-4-3-5-17-8-11/h3-8H,9H2,1-2H3,(H,18,19)
InChIKeyJHDHFTLHHPYKFU-UHFFFAOYSA-N
XLogP2.98
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]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

Related Compounds

N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyrazine-2-carboxamide
CID 110794198
N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]pyridine-3-carboxamide;hydrochloride
CID 110781248
N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]propanamide
CID 110782924
N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]butanamide
CID 110782925
N-[(2-methyl-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 175769075
N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]-3-hydroxypropanamide
CID 115139037
N-[(2-methoxy-4,6-dimethylphenyl)methyl]pyridine-3-carboxamide;hydrochloride
CID 110784884
N-[(4,6-dichloro-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 178023307
N-[(2,4,6-trimethoxyphenyl)methyl]pyridine-3-carboxamide
CID 110784319
N-[3-[(3,4,5-trimethoxybenzoyl)amino]propyl]pyridine-3-carboxamide
CID 108926572
N-[2-(2,4-dimethoxy-3-methylphenyl)ethyl]pyridine-3-carboxamide
CID 110789703
N-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]pyridine-3-carboxamide
CID 110705421

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide?
The IUPAC name of N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide (CID 110782938) is N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide?
The canonical SMILES for N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide is COc1c(C)cc(Cl)cc1CNC(=O)c1cccnc1.
What is the InChIKey of N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide?
The InChIKey is JHDHFTLHHPYKFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-6-13(16)7-12(14(10)20-2)9-18-15(19)11-4-3-5-17-8-11/h3-8H,9H2,1-2H3,(H,18,19).
What are the key properties of N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide?
N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-2-methoxy-3-methylphenyl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 110782938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).