N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide

C15H16ClN3O — CID 84575011

IUPACN-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide
SMILESCN(C)c1cccc(C(=O)NCc2ccccc2Cl)n1
InChIInChI=1S/C15H16ClN3O/c1-19(2)14-9-5-8-13(18-14)15(20)17-10-11-6-3-4-7-12(11)16/h3-9H,10H2,1-2H3,(H,17,20)
InChIKeyCGYGLZNRTAYMHY-UHFFFAOYSA-N
MW289.77 g/mol
LogP2.73
Rot. Bonds4

About N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide

N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide (PubChem CID 84575011) has the molecular formula C15H16ClN3O and a molecular weight of 289.77 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide
PubChem CID84575011
Molecular FormulaC15H16ClN3O
Molecular Weight289.77 g/mol
Exact Mass289.10
IUPAC NameN-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide
SMILESCN(C)c1cccc(C(=O)NCc2ccccc2Cl)n1
InChIInChI=1S/C15H16ClN3O/c1-19(2)14-9-5-8-13(18-14)15(20)17-10-11-6-3-4-7-12(11)16/h3-9H,10H2,1-2H3,(H,17,20)
InChIKeyCGYGLZNRTAYMHY-UHFFFAOYSA-N
XLogP2.73
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.77
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-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

2-N-[(2-chlorophenyl)methyl]-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094410
6-N-tert-butyl-2-N-[(2-chlorophenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097887
N-[(2-chlorophenyl)methyl]-6-methoxypyridine-2-carboxamide
CID 110851400
2-N-[(2-chlorophenyl)methyl]-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109093646
2-N-[(2-chlorophenyl)methyl]-6-N-(4-ethylphenyl)pyridine-2,6-dicarboxamide
CID 109097909
2-N-[(2-chlorophenyl)methyl]-6-N-(4-methoxyphenyl)pyridine-2,6-dicarboxamide
CID 109097915
N-[(2-chlorophenyl)methyl]-8-hydroxyquinoline-2-carboxamide
CID 46364203
6-[benzyl(methyl)amino]-N-[(2-chlorophenyl)methyl]pyridazine-3-carboxamide
CID 109118931
N-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]methyl]-2-(2-chlorophenyl)acetamide
CID 121137847
6-N-(3-chloro-2-methylphenyl)-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097382
6-N-(2-chlorophenyl)-2-N-[(2-methoxyphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097991
N-[(2-chlorophenyl)methyl]-3-methylthiophene-2-carboxamide
CID 2481080

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide (CID 84575011) is N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide is CN(C)c1cccc(C(=O)NCc2ccccc2Cl)n1.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide?
The InChIKey is CGYGLZNRTAYMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O/c1-19(2)14-9-5-8-13(18-14)15(20)17-10-11-6-3-4-7-12(11)16/h3-9H,10H2,1-2H3,(H,17,20).
What are the key properties of N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide?
N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide has a molecular weight of 289.77 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-6-(dimethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 84575011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).