2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide

C14H22N4O2 — CID 103483590

IUPAC2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)Cn1cnc2c(c1=O)CCNC2
InChIInChI=1S/C14H22N4O2/c1-3-4-10(2)17-13(19)8-18-9-16-12-7-15-6-5-11(12)14(18)20/h9-10,15H,3-8H2,1-2H3,(H,17,19)
InChIKeyVZWPQPNANMVPLL-UHFFFAOYSA-N
MW278.36 g/mol
LogP0.19
Rot. Bonds5

About 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide

2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide (PubChem CID 103483590) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide
PubChem CID103483590
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)Cn1cnc2c(c1=O)CCNC2
InChIInChI=1S/C14H22N4O2/c1-3-4-10(2)17-13(19)8-18-9-16-12-7-15-6-5-11(12)14(18)20/h9-10,15H,3-8H2,1-2H3,(H,17,19)
InChIKeyVZWPQPNANMVPLL-UHFFFAOYSA-N
XLogP0.19
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide 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

7-acetyl-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one
CID 136380778
tert-butyl 4-hydroxy-5H,6H,7H,8H-pyrido[3,4-d]pyrimidine-7-carboxylate
CID 135741723
3-methyl-3H,4H,5H,6H,7H,8H-pyrido(3,4-d)pyrimidin-4-one dihydrochloride
CID 86775360
7-[(2S)-2,3,3-trimethylbutanoyl]-3,5,6,8-tetrahydropyrido[3,4-d]pyrimidin-4-one
CID 164640445
3-methyl-3H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one
CID 75480674
5,6,7,8-Tetrahydropyrido[3,4-D]pyrimidin-4(3H)-one
CID 135741601
2-(dimethylamino)-7-D-prolyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(3H)-one
CID 136164906
2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 103483905
3-methyl-4-oxo-N-[(2S)-1,1,1-trifluoro-3-methylbutan-2-yl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-7-carboxamide
CID 146089896
N-cyclopentyl-2-(4-oxo-5,6,7,8-tetrahydroquinazolin-3-yl)acetamide
CID 53014418
5-[2-(2-ethyl-2-methyl-3-oxopiperazin-1-yl)-2-oxoethyl]-2,6-dimethylpyrimidin-4(3H)-one
CID 136052445
6-(1-Propanoylpyrrolidine-2-carbonyl)-3,5,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-one
CID 168453077

Frequently Asked Questions

What is the IUPAC name of 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide (CID 103483590) is 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)Cn1cnc2c(c1=O)CCNC2.
What is the InChIKey of 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide?
The InChIKey is VZWPQPNANMVPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-3-4-10(2)17-13(19)8-18-9-16-12-7-15-6-5-11(12)14(18)20/h9-10,15H,3-8H2,1-2H3,(H,17,19).
What are the key properties of 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide?
2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide has a molecular weight of 278.36 g/mol, XLogP of 0.19, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxo-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-3-yl)-N-pentan-2-ylacetamide is sourced from PubChem (CID 103483590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).