N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C15H17N3O2 — CID 19789644

IUPACN-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC1CCCC1NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H17N3O2/c1-10-5-4-6-12(10)17-14(19)11-9-16-13-7-2-3-8-18(13)15(11)20/h2-3,7-10,12H,4-6H2,1H3,(H,17,19)
InChIKeyXZECQTUIPOUBCG-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.61
Rot. Bonds2

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

N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 19789644) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID19789644
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC1CCCC1NC(=O)c1cnc2ccccn2c1=O
InChIInChI=1S/C15H17N3O2/c1-10-5-4-6-12(10)17-14(19)11-9-16-13-7-2-3-8-18(13)15(11)20/h2-3,7-10,12H,4-6H2,1H3,(H,17,19)
InChIKeyXZECQTUIPOUBCG-UHFFFAOYSA-N
XLogP1.61
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 19789644) is N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is CC1CCCC1NC(=O)c1cnc2ccccn2c1=O.
What is the InChIKey of N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is XZECQTUIPOUBCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-5-4-6-12(10)17-14(19)11-9-16-13-7-2-3-8-18(13)15(11)20/h2-3,7-10,12H,4-6H2,1H3,(H,17,19).
What are the key properties of N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopentyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 19789644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).