6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

C15H17N3O3 — CID 126668441

IUPAC6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1cccc2ncc(C(=O)NC3CCOCC3)c(=O)n12
InChIInChI=1S/C15H17N3O3/c1-10-3-2-4-13-16-9-12(15(20)18(10)13)14(19)17-11-5-7-21-8-6-11/h2-4,9,11H,5-8H2,1H3,(H,17,19)
InChIKeyNQGRGAGZPZXVOF-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.91
Rot. Bonds2

About 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide

6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 126668441) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID126668441
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCc1cccc2ncc(C(=O)NC3CCOCC3)c(=O)n12
InChIInChI=1S/C15H17N3O3/c1-10-3-2-4-13-16-9-12(15(20)18(10)13)14(19)17-11-5-7-21-8-6-11/h2-4,9,11H,5-8H2,1H3,(H,17,19)
InChIKeyNQGRGAGZPZXVOF-UHFFFAOYSA-N
XLogP0.91
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-N-(oxan-4-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

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide (CID 126668441) is 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is Cc1cccc2ncc(C(=O)NC3CCOCC3)c(=O)n12.
What is the InChIKey of 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is NQGRGAGZPZXVOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-10-3-2-4-13-16-9-12(15(20)18(10)13)14(19)17-11-5-7-21-8-6-11/h2-4,9,11H,5-8H2,1H3,(H,17,19).
What are the key properties of 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide?
6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(oxan-4-yl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 126668441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).