N-benzyl-4-pyridin-4-ylbenzamide

C19H16N2O — CID 11196984

IUPACN-benzyl-4-pyridin-4-ylbenzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C19H16N2O/c22-19(21-14-15-4-2-1-3-5-15)18-8-6-16(7-9-18)17-10-12-20-13-11-17/h1-13H,14H2,(H,21,22)
InChIKeySYSUZXPGQXEWCZ-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.68
Rot. Bonds4

About N-benzyl-4-pyridin-4-ylbenzamide

N-benzyl-4-pyridin-4-ylbenzamide (PubChem CID 11196984) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-benzyl-4-pyridin-4-ylbenzamide.

Molecular Properties

Compound NameN-benzyl-4-pyridin-4-ylbenzamide
PubChem CID11196984
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC NameN-benzyl-4-pyridin-4-ylbenzamide
SMILESO=C(NCc1ccccc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C19H16N2O/c22-19(21-14-15-4-2-1-3-5-15)18-8-6-16(7-9-18)17-10-12-20-13-11-17/h1-13H,14H2,(H,21,22)
InChIKeySYSUZXPGQXEWCZ-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 N-benzyl-4-pyridin-4-ylbenzamide?
The IUPAC name of N-benzyl-4-pyridin-4-ylbenzamide (CID 11196984) is N-benzyl-4-pyridin-4-ylbenzamide.
What is the SMILES notation for N-benzyl-4-pyridin-4-ylbenzamide?
The canonical SMILES for N-benzyl-4-pyridin-4-ylbenzamide is O=C(NCc1ccccc1)c1ccc(-c2ccncc2)cc1.
What is the InChIKey of N-benzyl-4-pyridin-4-ylbenzamide?
The InChIKey is SYSUZXPGQXEWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O/c22-19(21-14-15-4-2-1-3-5-15)18-8-6-16(7-9-18)17-10-12-20-13-11-17/h1-13H,14H2,(H,21,22).
What are the key properties of N-benzyl-4-pyridin-4-ylbenzamide?
N-benzyl-4-pyridin-4-ylbenzamide 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 N-benzyl-4-pyridin-4-ylbenzamide is sourced from PubChem (CID 11196984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).