N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide

C19H12Cl2N4O — CID 109222641

IUPACN-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide
SMILESN#Cc1ccc(NC(=O)c2cc(Nc3cc(Cl)ccc3Cl)ccn2)cc1
InChIInChI=1S/C19H12Cl2N4O/c20-13-3-6-16(21)17(9-13)24-15-7-8-23-18(10-15)19(26)25-14-4-1-12(11-22)2-5-14/h1-10H,(H,23,24)(H,25,26)
InChIKeyYMKIBJBHEREEME-UHFFFAOYSA-N
MW383.24 g/mol
LogP5.26
Rot. Bonds4

About N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide

N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide (PubChem CID 109222641) has the molecular formula C19H12Cl2N4O and a molecular weight of 383.24 g/mol. Its IUPAC name is N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide
PubChem CID109222641
Molecular FormulaC19H12Cl2N4O
Molecular Weight383.24 g/mol
Exact Mass382.04
IUPAC NameN-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide
SMILESN#Cc1ccc(NC(=O)c2cc(Nc3cc(Cl)ccc3Cl)ccn2)cc1
InChIInChI=1S/C19H12Cl2N4O/c20-13-3-6-16(21)17(9-13)24-15-7-8-23-18(10-15)19(26)25-14-4-1-12(11-22)2-5-14/h1-10H,(H,23,24)(H,25,26)
InChIKeyYMKIBJBHEREEME-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

4-(2,5-dichloroanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109221676
4-anilino-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 109218921
N-(4-cyanophenyl)-4-(2,3-dimethylanilino)pyridine-2-carboxamide
CID 109220123
N-(3-chloro-4-methylphenyl)-4-(4-cyanoanilino)pyridine-2-carboxamide
CID 109221263
4-(4-cyanoanilino)-N-(2,3-dichlorophenyl)pyridine-2-carboxamide
CID 109222661
4-(4-cyanoanilino)-N-(3-cyanophenyl)pyridine-2-carboxamide
CID 109222713
N-(4-cyanophenyl)-4-(propan-2-ylamino)pyridine-2-carboxamide
CID 109201674
2-N-(4-chloro-2-methylphenyl)-4-N-(4-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092943
4-N-(4-chloro-2-methylphenyl)-2-N-(4-cyanophenyl)pyridine-2,4-dicarboxamide
CID 109092935
4-(4-cyanoanilino)-N-[4-(diethylamino)phenyl]pyridine-2-carboxamide
CID 109222360
4-(2,5-dichloroanilino)pyridine-2-carbonitrile
CID 62926848
4-(2,5-dichloroanilino)-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 109213367

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide (CID 109222641) is N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide is N#Cc1ccc(NC(=O)c2cc(Nc3cc(Cl)ccc3Cl)ccn2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide?
The InChIKey is YMKIBJBHEREEME-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12Cl2N4O/c20-13-3-6-16(21)17(9-13)24-15-7-8-23-18(10-15)19(26)25-14-4-1-12(11-22)2-5-14/h1-10H,(H,23,24)(H,25,26).
What are the key properties of N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide?
N-(4-cyanophenyl)-4-(2,5-dichloroanilino)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 N-(4-cyanophenyl)-4-(2,5-dichloroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109222641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).