2,6-dimethylpyrido[1,2-a]pyrimidin-4-one

C10H10N2O — CID 599968

IUPAC2,6-dimethylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2c(C)cccc2n1
InChIInChI=1S/C10H10N2O/c1-7-6-10(13)12-8(2)4-3-5-9(12)11-7/h3-6H,1-2H3
InChIKeyUPQKNTNJVQSGIH-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.31
Rot. Bonds

About 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one

2,6-dimethylpyrido[1,2-a]pyrimidin-4-one (PubChem CID 599968) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2,6-dimethylpyrido[1,2-a]pyrimidin-4-one
PubChem CID599968
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name2,6-dimethylpyrido[1,2-a]pyrimidin-4-one
SMILESCc1cc(=O)n2c(C)cccc2n1
InChIInChI=1S/C10H10N2O/c1-7-6-10(13)12-8(2)4-3-5-9(12)11-7/h3-6H,1-2H3
InChIKeyUPQKNTNJVQSGIH-UHFFFAOYSA-N
XLogP1.31
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,8-dimethyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 4021578
3-chloro-2,6-dimethyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 3255478
3,6-Dimethyl-4H-pyrido(1,2-a)pyrimidin-4-one
CID 520938
2-Methyl-4H-pyrido(1,2-a)pyrimidin-4-one
CID 278093
4H-Pyrido(1,2-a)pyrimidin-4-one, 2,3,6-trimethyl-, monohydrochloride
CID 3053738
4H-Pyrido(1,2-a)pyrimidin-4-one, 3,6-dimethyl-2-ethyl-, monohydrochloride
CID 3053742
2-(chloromethyl)-6-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
CID 776367
4-Methyl-2H-pyrido[1,2-a]pyrimidin-2-one
CID 594758
4,6-Dimethyl-pyrido[1,2-a]pyrimidin-2-one
CID 11052146
6-Methyl-4H-pyrido(1,2-a)pyrimidin-4-one
CID 529103
4H-Pyrido[1,2-a]pyrimidin-4-one, 2-ethyl-3,6-dimethyl-
CID 3053743
7-Chloro-4-methyl-pyrido[1,2-a]pyrimidin-2-one
CID 11052538

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one (CID 599968) is 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one is Cc1cc(=O)n2c(C)cccc2n1.
What is the InChIKey of 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one?
The InChIKey is UPQKNTNJVQSGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-7-6-10(13)12-8(2)4-3-5-9(12)11-7/h3-6H,1-2H3.
What are the key properties of 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one?
2,6-dimethylpyrido[1,2-a]pyrimidin-4-one has a molecular weight of 174.20 g/mol, XLogP of 1.31, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylpyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 599968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).