3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one

C9H10N2O — CID 15755112

IUPAC3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one
SMILESCC1CN2C=CC=CC2=NC1=O
InChIInChI=1S/C9H10N2O/c1-7-6-11-5-3-2-4-8(11)10-9(7)12/h2-5,7H,6H2,1H3
InChIKeySIOVDWHMROIRQX-UHFFFAOYSA-N
MW162.19 g/mol
LogP0.95
Rot. Bonds

About 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one

3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one (PubChem CID 15755112) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one.

Molecular Properties

Compound Name3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one
PubChem CID15755112
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Name3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one
SMILESCC1CN2C=CC=CC2=NC1=O
InChIInChI=1S/C9H10N2O/c1-7-6-11-5-3-2-4-8(11)10-9(7)12/h2-5,7H,6H2,1H3
InChIKeySIOVDWHMROIRQX-UHFFFAOYSA-N
XLogP0.95
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one?
The IUPAC name of 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one (CID 15755112) is 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one.
What is the SMILES notation for 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one?
The canonical SMILES for 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one is CC1CN2C=CC=CC2=NC1=O.
What is the InChIKey of 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one?
The InChIKey is SIOVDWHMROIRQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c1-7-6-11-5-3-2-4-8(11)10-9(7)12/h2-5,7H,6H2,1H3.
What are the key properties of 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one?
3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one has a molecular weight of 162.19 g/mol, XLogP of 0.95, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3,4-dihydropyrido[1,2-a]pyrimidin-2-one is sourced from PubChem (CID 15755112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).