4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one

C17H15N3O2 — CID 137211742

IUPAC4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one
SMILESCc1ccc(-c2nc3cccnc3n(C3CC3)c2=O)c(O)c1
InChIInChI=1S/C17H15N3O2/c1-10-4-7-12(14(21)9-10)15-17(22)20(11-5-6-11)16-13(19-15)3-2-8-18-16/h2-4,7-9,11,21H,5-6H2,1H3
InChIKeyRIEGWTACJGCQNF-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.81
Rot. Bonds2

About 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one

4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one (PubChem CID 137211742) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one
PubChem CID137211742
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one
SMILESCc1ccc(-c2nc3cccnc3n(C3CC3)c2=O)c(O)c1
InChIInChI=1S/C17H15N3O2/c1-10-4-7-12(14(21)9-10)15-17(22)20(11-5-6-11)16-13(19-15)3-2-8-18-16/h2-4,7-9,11,21H,5-6H2,1H3
InChIKeyRIEGWTACJGCQNF-UHFFFAOYSA-N
XLogP2.81
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one?
The IUPAC name of 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one (CID 137211742) is 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one is Cc1ccc(-c2nc3cccnc3n(C3CC3)c2=O)c(O)c1.
What is the InChIKey of 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one?
The InChIKey is RIEGWTACJGCQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-10-4-7-12(14(21)9-10)15-17(22)20(11-5-6-11)16-13(19-15)3-2-8-18-16/h2-4,7-9,11,21H,5-6H2,1H3.
What are the key properties of 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one?
4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one has a molecular weight of 293.33 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-2-(2-hydroxy-4-methylphenyl)pyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 137211742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).