4-phenyl-N-pyridin-3-ylbenzamide

C18H14N2O — CID 790256

IUPAC4-phenyl-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H14N2O/c21-18(20-17-7-4-12-19-13-17)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h1-13H,(H,20,21)
InChIKeyYOVOGPYHFUQCOX-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.00
Rot. Bonds3

About 4-phenyl-N-pyridin-3-ylbenzamide

4-phenyl-N-pyridin-3-ylbenzamide (PubChem CID 790256) has the molecular formula C18H14N2O and a molecular weight of 274.32 g/mol. Its IUPAC name is 4-phenyl-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name4-phenyl-N-pyridin-3-ylbenzamide
PubChem CID790256
Molecular FormulaC18H14N2O
Molecular Weight274.32 g/mol
Exact Mass274.11
IUPAC Name4-phenyl-N-pyridin-3-ylbenzamide
SMILESO=C(Nc1cccnc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H14N2O/c21-18(20-17-7-4-12-19-13-17)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h1-13H,(H,20,21)
InChIKeyYOVOGPYHFUQCOX-UHFFFAOYSA-N
XLogP4.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-pyridin-3-ylbenzamide?
The IUPAC name of 4-phenyl-N-pyridin-3-ylbenzamide (CID 790256) is 4-phenyl-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 4-phenyl-N-pyridin-3-ylbenzamide?
The canonical SMILES for 4-phenyl-N-pyridin-3-ylbenzamide is O=C(Nc1cccnc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-pyridin-3-ylbenzamide?
The InChIKey is YOVOGPYHFUQCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O/c21-18(20-17-7-4-12-19-13-17)16-10-8-15(9-11-16)14-5-2-1-3-6-14/h1-13H,(H,20,21).
What are the key properties of 4-phenyl-N-pyridin-3-ylbenzamide?
4-phenyl-N-pyridin-3-ylbenzamide has a molecular weight of 274.32 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 790256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).