2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one

C13H15N3O2 — CID 79375277

IUPAC2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one
SMILESCOc1nc(C)cc(=O)n1CCc1ccccn1
InChIInChI=1S/C13H15N3O2/c1-10-9-12(17)16(13(15-10)18-2)8-6-11-5-3-4-7-14-11/h3-5,7,9H,6,8H2,1-2H3
InChIKeyFOFOKOKLPOCOKV-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.20
Rot. Bonds4

About 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one

2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one (PubChem CID 79375277) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one.

Molecular Properties

Compound Name2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one
PubChem CID79375277
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one
SMILESCOc1nc(C)cc(=O)n1CCc1ccccn1
InChIInChI=1S/C13H15N3O2/c1-10-9-12(17)16(13(15-10)18-2)8-6-11-5-3-4-7-14-11/h3-5,7,9H,6,8H2,1-2H3
InChIKeyFOFOKOKLPOCOKV-UHFFFAOYSA-N
XLogP1.20
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-amino-2-pyridinyl)methyl]-2-methoxy-6-methylpyrimidin-4-one
CID 79374827
2-[2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)ethoxy]benzonitrile
CID 79369825
3-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)propanoic acid
CID 79366215
2-methoxy-6-methyl-3-phenacylpyrimidin-4-one
CID 79374029
6-chloro-2-propan-2-yl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one
CID 114584819
2-methoxy-6-methyl-3-[2-(prop-2-enylamino)ethyl]pyrimidin-4-one
CID 79374762
3-[4-[4-(chloromethyl)-1,3-thiazol-2-yl]butyl]-2-methoxy-6-methylpyrimidin-4-one
CID 79370631
3-[2-(3-fluoroanilino)ethyl]-2-methoxy-6-methylpyrimidin-4-one
CID 79374119
2-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)acetonitrile
CID 79367231
3-(2-methoxy-4-methyl-6-oxopyrimidin-1-yl)-2-phenylpropanenitrile
CID 79366036
2-methoxy-6-methyl-3-[2-(3-methylbutylamino)ethyl]pyrimidin-4-one
CID 79374334
8-(3,5-dimethyl-1,2-oxazol-4-yl)-7-methoxy-1-(2-pyridin-2-ylethyl)quinolin-2-one
CID 135203487

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one?
The IUPAC name of 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one (CID 79375277) is 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one.
What is the SMILES notation for 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one?
The canonical SMILES for 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one is COc1nc(C)cc(=O)n1CCc1ccccn1.
What is the InChIKey of 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one?
The InChIKey is FOFOKOKLPOCOKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-10-9-12(17)16(13(15-10)18-2)8-6-11-5-3-4-7-14-11/h3-5,7,9H,6,8H2,1-2H3.
What are the key properties of 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one?
2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one has a molecular weight of 245.28 g/mol, XLogP of 1.20, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-methyl-3-(2-pyridin-2-ylethyl)pyrimidin-4-one is sourced from PubChem (CID 79375277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).