N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide

C15H11N3O3 — CID 137316980

IUPACN-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
SMILESO=C(Nc1c(O)nc2ccccn2c1=O)c1ccccc1
InChIInChI=1S/C15H11N3O3/c19-13(10-6-2-1-3-7-10)17-12-14(20)16-11-8-4-5-9-18(11)15(12)21/h1-9,20H,(H,17,19)
InChIKeyOVJYJPOJHJHBBO-UHFFFAOYSA-N
MW281.27 g/mol
LogP1.65
Rot. Bonds2

About N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide

N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide (PubChem CID 137316980) has the molecular formula C15H11N3O3 and a molecular weight of 281.27 g/mol. Its IUPAC name is N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide.

Molecular Properties

Compound NameN-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
PubChem CID137316980
Molecular FormulaC15H11N3O3
Molecular Weight281.27 g/mol
Exact Mass281.08
IUPAC NameN-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
SMILESO=C(Nc1c(O)nc2ccccn2c1=O)c1ccccc1
InChIInChI=1S/C15H11N3O3/c19-13(10-6-2-1-3-7-10)17-12-14(20)16-11-8-4-5-9-18(11)15(12)21/h1-9,20H,(H,17,19)
InChIKeyOVJYJPOJHJHBBO-UHFFFAOYSA-N
XLogP1.65
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.27
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chlorophenyl)-2-hydroxy-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 137278968
2-hydroxy-4-oxo-N-(2-phenylethyl)pyrido[1,2-a]pyrimidine-3-carboxamide
CID 135681057
N-(2-ethoxyphenyl)-2-hydroxy-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 137279230
4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
CID 763006
4-tert-butyl-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
CID 6457996
N-[4-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methoxy]phenyl]benzamide
CID 46355928
N-[2-[(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)amino]ethyl]benzamide
CID 47021470
N-acridin-9-ylbenzamide
CID 40532924
5-[(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)methylidene]-1,3-diazinane-2,4,6-trione
CID 137224601
2-hydroxy-3-(3-methylbutyl)pyrido[1,2-a]pyrimidin-4-one
CID 135870029
2-hydroxy-4-oxo-N-[(1R,5R)-3,3,5-trimethylcyclohexyl]pyrido[1,2-a]pyrimidine-3-carboxamide
CID 136696100
N-(2,6-dimethylphenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 4575304

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The IUPAC name of N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide (CID 137316980) is N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide.
What is the SMILES notation for N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The canonical SMILES for N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide is O=C(Nc1c(O)nc2ccccn2c1=O)c1ccccc1.
What is the InChIKey of N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The InChIKey is OVJYJPOJHJHBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O3/c19-13(10-6-2-1-3-7-10)17-12-14(20)16-11-8-4-5-9-18(11)15(12)21/h1-9,20H,(H,17,19).
What are the key properties of N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide has a molecular weight of 281.27 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide is sourced from PubChem (CID 137316980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).