N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C15H19N3O3 — CID 103945701

IUPACN-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCCC(C)(CCO)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H19N3O3/c1-3-15(2,7-9-19)17-13(20)11-10-16-12-6-4-5-8-18(12)14(11)21/h4-6,8,10,19H,3,7,9H2,1-2H3,(H,17,20)
InChIKeyFQBFKCBSAKWJMN-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.98
Rot. Bonds5

About N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 103945701) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID103945701
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC NameN-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCCC(C)(CCO)NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H19N3O3/c1-3-15(2,7-9-19)17-13(20)11-10-16-12-6-4-5-8-18(12)14(11)21/h4-6,8,10,19H,3,7,9H2,1-2H3,(H,17,20)
InChIKeyFQBFKCBSAKWJMN-UHFFFAOYSA-N
XLogP0.98
TPSA83.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide 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

2-hydroxy-N-(3-hydroxypropyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 135681039
N-(2-methylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 42937588
N-(3-hydroxypropyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 43417621
N-(1-hydroxybutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 43417935
N-(1-hydroxypropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 43418615
N-(1-hydroxy-2-methylpropan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 43500687
N-(3-hydroxypropyl)-4-oxo-N-propan-2-ylpyrido[1,2-a]pyrimidine-3-carboxamide
CID 61038580
N-(1-hydroxy-4-methylpentan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 61245333
N-[1-(hydroxymethyl)cyclopentyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 62519471
N-[3-(hydroxymethyl)pentan-3-yl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 62519774
N-(3-hydroxybutyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 64458520
N-(1-hydroxy-2-methylbutan-2-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 64556962

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 103945701) is N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is CCC(C)(CCO)NC(=O)c1cnc2ccccn2c1=O.
What is the InChIKey of N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is FQBFKCBSAKWJMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-3-15(2,7-9-19)17-13(20)11-10-16-12-6-4-5-8-18(12)14(11)21/h4-6,8,10,19H,3,7,9H2,1-2H3,(H,17,20).
What are the key properties of N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 289.33 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-3-methylpentan-3-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 103945701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).