4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide

C19H12Cl2N4O — CID 109222661

IUPAC4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(Nc2ccnc(C(=O)Nc3cccc(Cl)c3Cl)c2)cc1
InChIInChI=1S/C19H12Cl2N4O/c20-15-2-1-3-16(18(15)21)25-19(26)17-10-14(8-9-23-17)24-13-6-4-12(11-22)5-7-13/h1-10H,(H,23,24)(H,25,26)
InChIKeyVCZVLLKRIWBESY-UHFFFAOYSA-N
MW383.24 g/mol
LogP5.26
Rot. Bonds4

About 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide

4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide (PubChem CID 109222661) has the molecular formula C19H12Cl2N4O and a molecular weight of 383.24 g/mol. Its IUPAC name is 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
PubChem CID109222661
Molecular FormulaC19H12Cl2N4O
Molecular Weight383.24 g/mol
Exact Mass382.04
IUPAC Name4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(Nc2ccnc(C(=O)Nc3cccc(Cl)c3Cl)c2)cc1
InChIInChI=1S/C19H12Cl2N4O/c20-15-2-1-3-16(18(15)21)25-19(26)17-10-14(8-9-23-17)24-13-6-4-12(11-22)5-7-13/h1-10H,(H,23,24)(H,25,26)
InChIKeyVCZVLLKRIWBESY-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)-4-(2,3-dichloroanilino)pyridine-2-carboxamide
CID 109222663
4-(4-cyanoanilino)-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 109222713
4-anilino-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 109218921
N-(3-chloro-4-methylphenyl)-4-(4-cyanoanilino)pyridine-2-carboxamide
CID 109221263
N-(4-cyanophenyl)-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109220123
6-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-3-carboxamide
CID 109164958
4-(3-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222698
N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide
CID 109222641
4-cyano-N-(2,3-dichlorophenyl)benzamide
CID 23761721
4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
CID 109220873
4-(3-cyanoanilino)-N-phenylpyridine-2-carboxamide
CID 109218825
N-(2-chlorophenyl)-4-(4-ethoxyanilino)pyridine-2-carboxamide
CID 109220864

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide (CID 109222661) is 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide is N#Cc1ccc(Nc2ccnc(C(=O)Nc3cccc(Cl)c3Cl)c2)cc1.
What is the InChIKey of 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide?
The InChIKey is VCZVLLKRIWBESY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2N4O/c20-15-2-1-3-16(18(15)21)25-19(26)17-10-14(8-9-23-17)24-13-6-4-12(11-22)5-7-13/h1-10H,(H,23,24)(H,25,26).
What are the key properties of 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide?
4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-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 4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109222661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).