3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide

C13H7Cl2N3O — CID 66463010

IUPAC3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C13H7Cl2N3O/c14-9-2-1-8(6-16)12(5-9)18-13(19)10-3-4-17-7-11(10)15/h1-5,7H,(H,18,19)
InChIKeyLCMAIGKYUGTENB-UHFFFAOYSA-N
MW292.12 g/mol
LogP3.51
Rot. Bonds2

About 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide

3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide (PubChem CID 66463010) has the molecular formula C13H7Cl2N3O and a molecular weight of 292.12 g/mol. Its IUPAC name is 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide
PubChem CID66463010
Molecular FormulaC13H7Cl2N3O
Molecular Weight292.12 g/mol
Exact Mass291.00
IUPAC Name3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide
SMILESN#Cc1ccc(Cl)cc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C13H7Cl2N3O/c14-9-2-1-8(6-16)12(5-9)18-13(19)10-3-4-17-7-11(10)15/h1-5,7H,(H,18,19)
InChIKeyLCMAIGKYUGTENB-UHFFFAOYSA-N
XLogP3.51
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.12
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-cyanophenyl)-3-hydroxypyridine-4-carboxamide
CID 81446338
2-chloro-N-(5-chloro-2-cyanophenyl)-4-methylbenzamide
CID 106861258
4-chloro-N-(5-chloro-2-cyanophenyl)-6-methylpyridine-3-carboxamide
CID 81226633
2-chloro-N-(5-chloro-2-cyanophenyl)-5-hydroxybenzamide
CID 106501019
2-chloro-N-(5-chloro-2-cyanophenyl)furan-3-carboxamide
CID 106684843
5,6-dichloro-N-(5-chloro-2-cyanophenyl)pyridine-3-carboxamide
CID 60628665
2,4-dichloro-N-[3-[(2,4-dichlorobenzoyl)amino]-4-pyridinyl]benzamide
CID 23828920
N-(5-chloro-2-cyanophenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 60710472
2,6-dichloro-N-(5-chloro-2-cyanophenyl)benzamide
CID 60628736
N-(5-chloro-2-cyanophenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105386639
3-chloro-N-(5-chloro-2-propoxyphenyl)pyridine-4-carboxamide
CID 66462452
N-(5-chloro-2-cyanophenyl)-2,5-dimethylfuran-3-carboxamide
CID 60628705

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide?
The IUPAC name of 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide (CID 66463010) is 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide is N#Cc1ccc(Cl)cc1NC(=O)c1ccncc1Cl.
What is the InChIKey of 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide?
The InChIKey is LCMAIGKYUGTENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H7Cl2N3O/c14-9-2-1-8(6-16)12(5-9)18-13(19)10-3-4-17-7-11(10)15/h1-5,7H,(H,18,19).
What are the key properties of 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide?
3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide has a molecular weight of 292.12 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(5-chloro-2-cyanophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 66463010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).