7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one

C12H15N3O — CID 132584780

IUPAC7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one
SMILESCc1cnc2[nH]c(=O)c(CC(C)C)nc2c1
InChIInChI=1S/C12H15N3O/c1-7(2)4-10-12(16)15-11-9(14-10)5-8(3)6-13-11/h5-7H,4H2,1-3H3,(H,13,15,16)
InChIKeyQGRNPXOINNCATL-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.83
Rot. Bonds2

About 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one

7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one (PubChem CID 132584780) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one
PubChem CID132584780
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one
SMILESCc1cnc2[nH]c(=O)c(CC(C)C)nc2c1
InChIInChI=1S/C12H15N3O/c1-7(2)4-10-12(16)15-11-9(14-10)5-8(3)6-13-11/h5-7H,4H2,1-3H3,(H,13,15,16)
InChIKeyQGRNPXOINNCATL-UHFFFAOYSA-N
XLogP1.83
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-benzyl-7-methyl-4H-pyrido[2,3-b]pyrazin-3-one
CID 132584777
5-methyl-2-(2-methylpropyl)pyridine-3-carbaldehyde
CID 83914847
2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 122543721
3-ethyl-6-methyl-1H-1,8-naphthyridin-2-one
CID 118005009
3-methoxy-5-methyl-2-(2-methylpropyl)pyridine
CID 91230939
2,7-dimethyl-3H-pyrido[3,2-d]pyrimidin-4-one
CID 149062893
7-[(3-chlorophenyl)-imidazol-1-ylmethyl]-3-(2-methylpropyl)-1H-quinoxalin-2-one
CID 19875903
2-fluoro-5-methyl-1H-pyrrolo[2,3-b]pyridine
CID 143863729
2-[6-methyl-2-(2-methylpropyl)imidazo[4,5-b]pyridin-3-yl]propanoic acid
CID 82061452
6-(2-methylpropyl)-3-pyrimidin-2-yl-4H-1,2,4-triazin-5-one
CID 136502815
6-[(4-hydroxyphenyl)methyl]-3-(2-methylpropyl)-1H-pyrazin-2-one
CID 132599737
6-methyl-2-(2-methylpropyl)quinazoline
CID 151740108

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one?
The IUPAC name of 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one (CID 132584780) is 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one is Cc1cnc2[nH]c(=O)c(CC(C)C)nc2c1.
What is the InChIKey of 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one?
The InChIKey is QGRNPXOINNCATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-7(2)4-10-12(16)15-11-9(14-10)5-8(3)6-13-11/h5-7H,4H2,1-3H3,(H,13,15,16).
What are the key properties of 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one?
7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one has a molecular weight of 217.27 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(2-methylpropyl)-4H-pyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 132584780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).