N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide

C18H12Cl3N3O — CID 23632653

IUPACN-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cccnc1Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H12Cl3N3O/c19-13-8-7-11(10-15(13)21)23-17-12(4-3-9-22-17)18(25)24-16-6-2-1-5-14(16)20/h1-10H,(H,22,23)(H,24,25)
InChIKeyOWYIDFADHCBWEQ-UHFFFAOYSA-N
MW392.67 g/mol
LogP6.04
Rot. Bonds4

About N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide

N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide (PubChem CID 23632653) has the molecular formula C18H12Cl3N3O and a molecular weight of 392.67 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide
PubChem CID23632653
Molecular FormulaC18H12Cl3N3O
Molecular Weight392.67 g/mol
Exact Mass391.00
IUPAC NameN-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1cccnc1Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C18H12Cl3N3O/c19-13-8-7-11(10-15(13)21)23-17-12(4-3-9-22-17)18(25)24-16-6-2-1-5-14(16)20/h1-10H,(H,22,23)(H,24,25)
InChIKeyOWYIDFADHCBWEQ-UHFFFAOYSA-N
XLogP6.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.67
LogP ≤ 56.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromoanilino)-N-(2-chlorophenyl)pyridine-3-carboxamide
CID 23632649
N-(4-bromophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide
CID 23632625
N-(2-chlorophenyl)-2-(2-fluoroanilino)pyridine-3-carboxamide
CID 23632658
N-(2-chlorophenyl)-2-[4-(trifluoromethoxy)anilino]pyridine-3-carboxamide
CID 23632659
N-(3,4-dichlorophenyl)-2-(2-methoxyanilino)pyridine-3-carboxamide
CID 23632728
N-(3,4-dichlorophenyl)-2-(4-methoxyanilino)pyridine-3-carboxamide
CID 23632726
2-(3,4-dichloroanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 23632578
N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyrimidine-4-carboxamide
CID 109316799
2-(2-chloroanilino)-N-(2,6-dimethylphenyl)pyridine-3-carboxamide
CID 23633001
2-(2-chloroanilino)-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 23632330
N-(2-anilino-3-pyridinyl)-2-(4-fluoroanilino)pyridine-3-carboxamide
CID 118724324
2-chloro-N-(2-chloro-3-pyridinyl)benzamide
CID 4245221

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide (CID 23632653) is N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide is O=C(Nc1ccccc1Cl)c1cccnc1Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide?
The InChIKey is OWYIDFADHCBWEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12Cl3N3O/c19-13-8-7-11(10-15(13)21)23-17-12(4-3-9-22-17)18(25)24-16-6-2-1-5-14(16)20/h1-10H,(H,22,23)(H,24,25).
What are the key properties of N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide?
N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide has a molecular weight of 392.67 g/mol, XLogP of 6.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(3,4-dichloroanilino)pyridine-3-carboxamide is sourced from PubChem (CID 23632653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).