4-phenyl-N-(pyridin-4-ylmethyl)benzamide

C19H16N2O — CID 2053915

IUPAC4-phenyl-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H16N2O/c22-19(21-14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-13H,14H2,(H,21,22)
InChIKeyJBXPVMOIWQIHRH-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.68
Rot. Bonds4

About 4-phenyl-N-(pyridin-4-ylmethyl)benzamide

4-phenyl-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 2053915) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is 4-phenyl-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name4-phenyl-N-(pyridin-4-ylmethyl)benzamide
PubChem CID2053915
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name4-phenyl-N-(pyridin-4-ylmethyl)benzamide
SMILESO=C(NCc1ccncc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H16N2O/c22-19(21-14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-13H,14H2,(H,21,22)
InChIKeyJBXPVMOIWQIHRH-UHFFFAOYSA-N
XLogP3.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.68
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-4-ylmethyl)benzamide?
The IUPAC name of 4-phenyl-N-(pyridin-4-ylmethyl)benzamide (CID 2053915) is 4-phenyl-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 4-phenyl-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 4-phenyl-N-(pyridin-4-ylmethyl)benzamide is O=C(NCc1ccncc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is JBXPVMOIWQIHRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c22-19(21-14-15-10-12-20-13-11-15)18-8-6-17(7-9-18)16-4-2-1-3-5-16/h1-13H,14H2,(H,21,22).
What are the key properties of 4-phenyl-N-(pyridin-4-ylmethyl)benzamide?
4-phenyl-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 288.35 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 2053915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).