9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one

C10H10N2O2 — CID 21436684

IUPAC9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2ccc(C)c(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-6-3-4-12-8(13)5-7(2)11-10(12)9(6)14/h3-5,14H,1-2H3
InChIKeyGFTCUGGAQYQSAH-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.02
Rot. Bonds

About 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one

9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 21436684) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one
PubChem CID21436684
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2ccc(C)c(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-6-3-4-12-8(13)5-7(2)11-10(12)9(6)14/h3-5,14H,1-2H3
InChIKeyGFTCUGGAQYQSAH-UHFFFAOYSA-N
XLogP1.02
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 288320
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CID 760815
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CID 870036
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CID 135426874
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CID 12369824
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CID 12527413
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CID 135426875
CID 135426875

Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one (CID 21436684) is 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one is Cc1cc(=O)n2ccc(C)c(O)c2n1.
What is the InChIKey of 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is GFTCUGGAQYQSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-6-3-4-12-8(13)5-7(2)11-10(12)9(6)14/h3-5,14H,1-2H3.
What are the key properties of 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one?
9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 190.20 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-2,8-dimethylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 21436684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).