N,1-dibenzyl-2-oxopyridine-3-carboxamide

C20H18N2O2 — CID 571691

IUPACN,1-dibenzyl-2-oxopyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1cccn(Cc2ccccc2)c1=O
InChIInChI=1S/C20H18N2O2/c23-19(21-14-16-8-3-1-4-9-16)18-12-7-13-22(20(18)24)15-17-10-5-2-6-11-17/h1-13H,14-15H2,(H,21,23)
InChIKeyYFFVFKUJIXEYQZ-UHFFFAOYSA-N
MW318.38 g/mol
LogP2.83
Rot. Bonds5

About N,1-dibenzyl-2-oxopyridine-3-carboxamide

N,1-dibenzyl-2-oxopyridine-3-carboxamide (PubChem CID 571691) has the molecular formula C20H18N2O2 and a molecular weight of 318.38 g/mol. Its IUPAC name is N,1-dibenzyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN,1-dibenzyl-2-oxopyridine-3-carboxamide
PubChem CID571691
Molecular FormulaC20H18N2O2
Molecular Weight318.38 g/mol
Exact Mass318.14
IUPAC NameN,1-dibenzyl-2-oxopyridine-3-carboxamide
SMILESO=C(NCc1ccccc1)c1cccn(Cc2ccccc2)c1=O
InChIInChI=1S/C20H18N2O2/c23-19(21-14-16-8-3-1-4-9-16)18-12-7-13-22(20(18)24)15-17-10-5-2-6-11-17/h1-13H,14-15H2,(H,21,23)
InChIKeyYFFVFKUJIXEYQZ-UHFFFAOYSA-N
XLogP2.83
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,1-dibenzyl-2-oxopyridine-3-carboxamide?
The IUPAC name of N,1-dibenzyl-2-oxopyridine-3-carboxamide (CID 571691) is N,1-dibenzyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N,1-dibenzyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for N,1-dibenzyl-2-oxopyridine-3-carboxamide is O=C(NCc1ccccc1)c1cccn(Cc2ccccc2)c1=O.
What is the InChIKey of N,1-dibenzyl-2-oxopyridine-3-carboxamide?
The InChIKey is YFFVFKUJIXEYQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2/c23-19(21-14-16-8-3-1-4-9-16)18-12-7-13-22(20(18)24)15-17-10-5-2-6-11-17/h1-13H,14-15H2,(H,21,23).
What are the key properties of N,1-dibenzyl-2-oxopyridine-3-carboxamide?
N,1-dibenzyl-2-oxopyridine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dibenzyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 571691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).