2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one

C11H13N3O — CID 122543721

IUPAC2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1cnc2[nH]c(=O)c(C(C)C)cc2n1
InChIInChI=1S/C11H13N3O/c1-6(2)8-4-9-10(14-11(8)15)12-5-7(3)13-9/h4-6H,1-3H3,(H,12,14,15)
InChIKeyYMYCZUQNVBLERP-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.75
Rot. Bonds1

About 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one

2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one (PubChem CID 122543721) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one
PubChem CID122543721
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC Name2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1cnc2[nH]c(=O)c(C(C)C)cc2n1
InChIInChI=1S/C11H13N3O/c1-6(2)8-4-9-10(14-11(8)15)12-5-7(3)13-9/h4-6H,1-3H3,(H,12,14,15)
InChIKeyYMYCZUQNVBLERP-UHFFFAOYSA-N
XLogP1.75
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one (CID 122543721) is 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one is Cc1cnc2[nH]c(=O)c(C(C)C)cc2n1.
What is the InChIKey of 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The InChIKey is YMYCZUQNVBLERP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-6(2)8-4-9-10(14-11(8)15)12-5-7(3)13-9/h4-6H,1-3H3,(H,12,14,15).
What are the key properties of 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one?
2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one has a molecular weight of 203.24 g/mol, XLogP of 1.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-propan-2-yl-5H-pyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 122543721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).