2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide

C19H13N3O — CID 51255858

IUPAC2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide
SMILESN#Cc1ccccc1-c1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C19H13N3O/c20-12-14-6-1-2-8-16(14)17-9-3-4-10-18(17)19(23)22-15-7-5-11-21-13-15/h1-11,13H,(H,22,23)
InChIKeyDCUDHHXXEAMHPJ-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.87
Rot. Bonds3

About 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide

2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide (PubChem CID 51255858) has the molecular formula C19H13N3O and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide
PubChem CID51255858
Molecular FormulaC19H13N3O
Molecular Weight299.33 g/mol
Exact Mass299.11
IUPAC Name2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide
SMILESN#Cc1ccccc1-c1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C19H13N3O/c20-12-14-6-1-2-8-16(14)17-9-3-4-10-18(17)19(23)22-15-7-5-11-21-13-15/h1-11,13H,(H,22,23)
InChIKeyDCUDHHXXEAMHPJ-UHFFFAOYSA-N
XLogP3.87
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide (CID 51255858) is 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide is N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccnc1.
What is the InChIKey of 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide?
The InChIKey is DCUDHHXXEAMHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13N3O/c20-12-14-6-1-2-8-16(14)17-9-3-4-10-18(17)19(23)22-15-7-5-11-21-13-15/h1-11,13H,(H,22,23).
What are the key properties of 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide?
2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide has a molecular weight of 299.33 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenyl)-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 51255858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).