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

C18H11ClN4O — CID 59672679

IUPAC5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(-c2ncccc2Cl)cn1
InChIInChI=1S/C18H11ClN4O/c19-14-5-3-9-21-17(14)13-7-8-16(22-11-13)18(24)23-15-6-2-1-4-12(15)10-20/h1-9,11H,(H,23,24)
InChIKeyVBWDWXSXXBFWIL-UHFFFAOYSA-N
MW334.77 g/mol
LogP3.92
Rot. Bonds3

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

5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide (PubChem CID 59672679) has the molecular formula C18H11ClN4O and a molecular weight of 334.77 g/mol. Its IUPAC name is 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide
PubChem CID59672679
Molecular FormulaC18H11ClN4O
Molecular Weight334.77 g/mol
Exact Mass334.06
IUPAC Name5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccccc1NC(=O)c1ccc(-c2ncccc2Cl)cn1
InChIInChI=1S/C18H11ClN4O/c19-14-5-3-9-21-17(14)13-7-8-16(22-11-13)18(24)23-15-6-2-1-4-12(15)10-20/h1-9,11H,(H,23,24)
InChIKeyVBWDWXSXXBFWIL-UHFFFAOYSA-N
XLogP3.92
TPSA78.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.77
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-chloro-2-pyridinyl)-N-(3-hydroxyphenyl)pyridine-2-carboxamide
CID 143032820
5-(2-cyanoanilino)-N-(2-cyanophenyl)pyrazine-2-carboxamide
CID 109294656
5-N-(2-chlorophenyl)-3-N-(2-cyanophenyl)pyridine-3,5-dicarboxamide
CID 109108776
6-amino-N-(2-cyanophenyl)pyridazine-3-carboxamide
CID 55043296
1-N-(2-cyanophenyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109050221
3,4-dichloro-N-(2-cyanophenyl)benzamide
CID 798668
N-(2-cyanophenyl)-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191731
N-(2-cyanophenyl)-6-(2,6-dichloroanilino)pyridazine-3-carboxamide
CID 109130305
N-(2-cyanophenyl)-6-pyridin-2-ylimidazo[1,2-a]pyridine-2-carboxamide
CID 68777542
N-(3-chloro-4-methoxyphenyl)-5-(3-chloro-2-pyridinyl)pyridine-2-carboxamide
CID 59672928
N-(2-cyanophenyl)-4-(2,3-dichloroanilino)pyridine-2-carboxamide
CID 109222663
N-(2-cyanophenyl)-1,3-thiazole-4-carboxamide
CID 63024235

Frequently Asked Questions

What is the IUPAC name of 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide (CID 59672679) is 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide is N#Cc1ccccc1NC(=O)c1ccc(-c2ncccc2Cl)cn1.
What is the InChIKey of 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The InChIKey is VBWDWXSXXBFWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClN4O/c19-14-5-3-9-21-17(14)13-7-8-16(22-11-13)18(24)23-15-6-2-1-4-12(15)10-20/h1-9,11H,(H,23,24).
What are the key properties of 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide?
5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide has a molecular weight of 334.77 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-chloro-2-pyridinyl)-N-(2-cyanophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 59672679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).