2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one

C10H12N4O — CID 136728596

IUPAC2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESCCc1cc(C)nc2nc(N)[nH]c(=O)c12
InChIInChI=1S/C10H12N4O/c1-3-6-4-5(2)12-8-7(6)9(15)14-10(11)13-8/h4H,3H2,1-2H3,(H3,11,12,13,14,15)
InChIKeyZASCNJHHOCXYLY-UHFFFAOYSA-N
MW204.23 g/mol
LogP0.77
Rot. Bonds1

About 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one

2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one (PubChem CID 136728596) has the molecular formula C10H12N4O and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one
PubChem CID136728596
Molecular FormulaC10H12N4O
Molecular Weight204.23 g/mol
Exact Mass204.10
IUPAC Name2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one
SMILESCCc1cc(C)nc2nc(N)[nH]c(=O)c12
InChIInChI=1S/C10H12N4O/c1-3-6-4-5(2)12-8-7(6)9(15)14-10(11)13-8/h4H,3H2,1-2H3,(H3,11,12,13,14,15)
InChIKeyZASCNJHHOCXYLY-UHFFFAOYSA-N
XLogP0.77
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-9-ethyl-3H-pyrimido[4,5-b]quinolin-4-one
CID 136866367
2,5,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135767387
2-amino-5-ethyl-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
CID 82055580
2-[2-(4-ethylphenyl)-2-oxoethyl]sulfanyl-5,7-dimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135441412
2,7-diamino-5-butyl-4-oxo-3H-pyrido[2,3-d]pyrimidine-6-carbonitrile
CID 135847939
2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 135438441
ethyl 2-amino-5-(3,4-dimethoxyphenyl)-4-oxo-3H-pyrido[2,3-d]pyrimidine-7-carboxylate
CID 137290037
ethyl 2-amino-5-(3-methoxyphenyl)-4-oxo-3H-pyrido[2,3-d]pyrimidine-7-carboxylate
CID 137290035
2-amino-5-methyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one;hydrochloride
CID 165438335
2-[(5,7-dimethyl-4-oxo-3H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 135671587
2-amino-5-(aminomethyl)-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
CID 135398563
2-[(5,7-dimethyl-4-oxo-3H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-propylacetamide
CID 135671586

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The IUPAC name of 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one (CID 136728596) is 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The canonical SMILES for 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one is CCc1cc(C)nc2nc(N)[nH]c(=O)c12.
What is the InChIKey of 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one?
The InChIKey is ZASCNJHHOCXYLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O/c1-3-6-4-5(2)12-8-7(6)9(15)14-10(11)13-8/h4H,3H2,1-2H3,(H3,11,12,13,14,15).
What are the key properties of 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one?
2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one has a molecular weight of 204.23 g/mol, XLogP of 0.77, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-ethyl-7-methyl-3H-pyrido[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 136728596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).