N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide

C19H12Cl2N4O — CID 109246343

IUPACN-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cncc(Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C19H12Cl2N4O/c20-14-6-15(21)8-16(7-14)24-17-5-13(10-23-11-17)19(26)25-18-4-2-1-3-12(18)9-22/h1-8,10-11,24H,(H,25,26)
InChIKeyKEISSBOQNDRKJT-UHFFFAOYSA-N
MW383.24 g/mol
LogP5.26
Rot. Bonds4

About N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide

N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide (PubChem CID 109246343) has the molecular formula C19H12Cl2N4O and a molecular weight of 383.24 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide
PubChem CID109246343
Molecular FormulaC19H12Cl2N4O
Molecular Weight383.24 g/mol
Exact Mass382.04
IUPAC NameN-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1cncc(Nc2cc(Cl)cc(Cl)c2)c1
InChIInChI=1S/C19H12Cl2N4O/c20-14-6-15(21)8-16(7-14)24-17-5-13(10-23-11-17)19(26)25-18-4-2-1-3-12(18)9-22/h1-8,10-11,24H,(H,25,26)
InChIKeyKEISSBOQNDRKJT-UHFFFAOYSA-N
XLogP5.26
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.24
LogP ≤ 55.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyanophenyl)-5-(2-methylanilino)pyridine-3-carboxamide
CID 109241817
5-N-(2-chlorophenyl)-3-N-(2-cyanophenyl)pyridine-3,5-dicarboxamide
CID 109108776
5-[(2-chlorophenyl)methylamino]-N-(2-cyanophenyl)pyridine-3-carboxamide
CID 109233966
N-(4-acetamidophenyl)-5-(2-cyanoanilino)pyridine-3-carboxamide
CID 109245887
N-(2-cyanophenyl)-6-(3,5-dichloroanilino)pyrimidine-4-carboxamide
CID 109359869
5-(2-cyanoanilino)-N-(2,4-dimethylphenyl)pyridine-3-carboxamide
CID 109242712
5-(2-cyanoanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 109243164
N-(2-cyanophenyl)-5-(2-methoxy-5-methylanilino)pyridine-3-carboxamide
CID 109245547
5-(2-cyanoanilino)-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 109243961
5-(3,5-dichloroanilino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109241902
N-(2-chlorophenyl)-5-(3,5-dimethylanilino)pyridine-3-carboxamide
CID 109243068
N-(2-bromophenyl)-5-(4-cyanoanilino)pyridine-3-carboxamide
CID 109246141

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide (CID 109246343) is N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide is N#Cc1ccccc1NC(=O)c1cncc(Nc2cc(Cl)cc(Cl)c2)c1.
What is the InChIKey of N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide?
The InChIKey is KEISSBOQNDRKJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2N4O/c20-14-6-15(21)8-16(7-14)24-17-5-13(10-23-11-17)19(26)25-18-4-2-1-3-12(18)9-22/h1-8,10-11,24H,(H,25,26).
What are the key properties of N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide?
N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide has a molecular weight of 383.24 g/mol, XLogP of 5.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(3,5-dichloroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109246343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).