N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide

C20H15Cl2N3O2 — CID 16730950

IUPACN-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide
SMILESCc1nc(Cl)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C20H15Cl2N3O2/c1-12-15(8-10-18(22)23-12)20(27)24-14-7-9-16(21)17(11-14)25-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,24,27)(H,25,26)
InChIKeyMDHDXACOTZFIHY-UHFFFAOYSA-N
MW400.27 g/mol
LogP5.20
Rot. Bonds4

About N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide

N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide (PubChem CID 16730950) has the molecular formula C20H15Cl2N3O2 and a molecular weight of 400.27 g/mol. Its IUPAC name is N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide
PubChem CID16730950
Molecular FormulaC20H15Cl2N3O2
Molecular Weight400.27 g/mol
Exact Mass399.05
IUPAC NameN-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide
SMILESCc1nc(Cl)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C20H15Cl2N3O2/c1-12-15(8-10-18(22)23-12)20(27)24-14-7-9-16(21)17(11-14)25-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,24,27)(H,25,26)
InChIKeyMDHDXACOTZFIHY-UHFFFAOYSA-N
XLogP5.20
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.27
LogP ≤ 55.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-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

6-chloro-N-[4-chloro-3-(4-fluoroanilino)phenyl]-2-methylpyridine-3-carboxamide
CID 87758912
N-(3-benzamido-4-chlorophenyl)-2-iodobenzamide
CID 1104044
N-[4-chloro-3-[(3-chlorobenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 16730636
N-(3-benzamido-4-chlorophenyl)naphthalene-1-carboxamide
CID 1104039
N-(3-benzamido-4-chlorophenyl)-2-fluorobenzamide
CID 1104031
N-[4-chloro-3-[(2-fluorobenzoyl)amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 16730638
N-[2-chloro-5-(phenylcarbamoyl)phenyl]-2-methylquinoline-3-carboxamide
CID 86982673
N-(3-benzamido-4-chlorophenyl)-4-(1,1-dioxothiazetidin-2-yl)-2-methylbenzamide
CID 90129924
N-[4-chloro-3-[[4-(thiadiazol-4-yl)benzoyl]amino]phenyl]-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 16730716
N-(4-amino-3,5-dichlorophenyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 55464176
N-(3-benzamido-4-chlorophenyl)-3-nitrobenzamide
CID 4620848
N-(3-benzamido-4-chlorophenyl)-4-(4,4-dioxo-1,4,3-oxathiazinan-3-yl)-2-methylbenzamide
CID 90130358

Frequently Asked Questions

What is the IUPAC name of N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide?
The IUPAC name of N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide (CID 16730950) is N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide is Cc1nc(Cl)ccc1C(=O)Nc1ccc(Cl)c(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide?
The InChIKey is MDHDXACOTZFIHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2N3O2/c1-12-15(8-10-18(22)23-12)20(27)24-14-7-9-16(21)17(11-14)25-19(26)13-5-3-2-4-6-13/h2-11H,1H3,(H,24,27)(H,25,26).
What are the key properties of N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide?
N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide has a molecular weight of 400.27 g/mol, XLogP of 5.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzamido-4-chlorophenyl)-6-chloro-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 16730950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).