9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one

C17H14N4O — CID 175920486

IUPAC9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccn2c(=O)cc(-c3ccc4nn(C)cc4c3)nc12
InChIInChI=1S/C17H14N4O/c1-11-4-3-7-21-16(22)9-15(18-17(11)21)12-5-6-14-13(8-12)10-20(2)19-14/h3-10H,1-2H3
InChIKeyWLTFTOAZIHUJIO-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.56
Rot. Bonds1

About 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one

9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 175920486) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
PubChem CID175920486
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccn2c(=O)cc(-c3ccc4nn(C)cc4c3)nc12
InChIInChI=1S/C17H14N4O/c1-11-4-3-7-21-16(22)9-15(18-17(11)21)12-5-6-14-13(8-12)10-20(2)19-14/h3-10H,1-2H3
InChIKeyWLTFTOAZIHUJIO-UHFFFAOYSA-N
XLogP2.56
TPSA52.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one (CID 175920486) is 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one is Cc1cccn2c(=O)cc(-c3ccc4nn(C)cc4c3)nc12.
What is the InChIKey of 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is WLTFTOAZIHUJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-11-4-3-7-21-16(22)9-15(18-17(11)21)12-5-6-14-13(8-12)10-20(2)19-14/h3-10H,1-2H3.
What are the key properties of 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one?
9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 290.33 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-2-(2-methylindazol-5-yl)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 175920486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).