5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide

C19H14Cl2FN3O — CID 109189695

IUPAC5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C19H14Cl2FN3O/c20-15-2-1-3-16(18(15)21)25-14-8-9-17(23-11-14)19(26)24-10-12-4-6-13(22)7-5-12/h1-9,11,25H,10H2,(H,24,26)
InChIKeyGNKBVJLQEOXNJN-UHFFFAOYSA-N
MW390.25 g/mol
LogP5.20
Rot. Bonds5

About 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide

5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide (PubChem CID 109189695) has the molecular formula C19H14Cl2FN3O and a molecular weight of 390.25 g/mol. Its IUPAC name is 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide
PubChem CID109189695
Molecular FormulaC19H14Cl2FN3O
Molecular Weight390.25 g/mol
Exact Mass389.05
IUPAC Name5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C19H14Cl2FN3O/c20-15-2-1-3-16(18(15)21)25-14-8-9-17(23-11-14)19(26)24-10-12-4-6-13(22)7-5-12/h1-9,11,25H,10H2,(H,24,26)
InChIKeyGNKBVJLQEOXNJN-UHFFFAOYSA-N
XLogP5.20
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.25
LogP ≤ 55.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]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-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyrimidine-4-carboxamide
CID 109305735
N-[(4-fluorophenyl)methyl]-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109189659
5-(2,3-dichloroanilino)-N-(furan-2-ylmethyl)pyridine-2-carboxamide
CID 109187637
5-(2,3-dichloroanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
CID 109292522
N-(2,3-dichlorophenyl)-5-[(4-fluorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281781
N-[(4-fluorophenyl)methyl]-5-[(3-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109188488
5-anilino-N-benzylpyridine-2-carboxamide
CID 109187879
6-(2-chloroanilino)-N-[(4-fluorophenyl)methyl]pyrimidine-4-carboxamide
CID 109348438
5-(3-fluoroanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190439
2,6-dichloro-N-[(4-fluorophenyl)methyl]benzamide
CID 841148
5-(4-acetamidoanilino)-N-[(4-chlorophenyl)methyl]pyridine-2-carboxamide
CID 109190050
N-butyl-5-(2,3-dichloroanilino)-N-methylpyridine-2-carboxamide
CID 109196018

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide?
The IUPAC name of 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide (CID 109189695) is 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide is O=C(NCc1ccc(F)cc1)c1ccc(Nc2cccc(Cl)c2Cl)cn1.
What is the InChIKey of 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide?
The InChIKey is GNKBVJLQEOXNJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2FN3O/c20-15-2-1-3-16(18(15)21)25-14-8-9-17(23-11-14)19(26)24-10-12-4-6-13(22)7-5-12/h1-9,11,25H,10H2,(H,24,26).
What are the key properties of 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide?
5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide has a molecular weight of 390.25 g/mol, XLogP of 5.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-dichloroanilino)-N-[(4-fluorophenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 109189695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).