2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one

C10H10N2O2 — CID 59532553

IUPAC2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one
SMILESCCc1cc(=O)n2cccc(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-2-7-6-9(14)12-5-3-4-8(13)10(12)11-7/h3-6,13H,2H2,1H3
InChIKeyDBYGNZBNPSKSJC-UHFFFAOYSA-N
MW190.20 g/mol
LogP0.96
Rot. Bonds1

About 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one

2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one (PubChem CID 59532553) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one
PubChem CID59532553
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one
SMILESCCc1cc(=O)n2cccc(O)c2n1
InChIInChI=1S/C10H10N2O2/c1-2-7-6-9(14)12-5-3-4-8(13)10(12)11-7/h3-6,13H,2H2,1H3
InChIKeyDBYGNZBNPSKSJC-UHFFFAOYSA-N
XLogP0.96
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one (CID 59532553) is 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one is CCc1cc(=O)n2cccc(O)c2n1.
What is the InChIKey of 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one?
The InChIKey is DBYGNZBNPSKSJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-2-7-6-9(14)12-5-3-4-8(13)10(12)11-7/h3-6,13H,2H2,1H3.
What are the key properties of 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one?
2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one has a molecular weight of 190.20 g/mol, XLogP of 0.96, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-9-hydroxypyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 59532553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).