6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one

C10H14N2O2 — CID 126954677

IUPAC6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one
SMILESCn1cnc(OCC2CCC2)cc1=O
InChIInChI=1S/C10H14N2O2/c1-12-7-11-9(5-10(12)13)14-6-8-3-2-4-8/h5,7-8H,2-4,6H2,1H3
InChIKeyJSTAZYDMZIBVMR-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.96
Rot. Bonds3

About 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one

6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one (PubChem CID 126954677) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one.

Molecular Properties

Compound Name6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one
PubChem CID126954677
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one
SMILESCn1cnc(OCC2CCC2)cc1=O
InChIInChI=1S/C10H14N2O2/c1-12-7-11-9(5-10(12)13)14-6-8-3-2-4-8/h5,7-8H,2-4,6H2,1H3
InChIKeyJSTAZYDMZIBVMR-UHFFFAOYSA-N
XLogP0.96
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(3,3-difluorocyclobutyl)methoxy]-3-methylpyrimidin-4-one
CID 126954698
3-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidin-4-one
CID 126874409
4-chloro-2-(cyclobutylmethoxy)pyridine
CID 71303294
5-bromo-2-(cyclopentylmethoxy)-4-methylpyridine
CID 114870777
3-(cyclobutylmethoxy)-1-methylindazole-6-carboxylic acid
CID 112757809
methyl 3-(cyclopropylmethoxy)-1-methylpyrazole-5-carboxylate
CID 146278831
6-(cyclobutylmethoxy)phthalazine-1,4-dione
CID 163203937
[2-(cycloheptylmethoxy)-4-pyridinyl]methanamine
CID 114247934
4-cyclobutyl-6-[[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-4-yl]methoxy]pyrimidine
CID 134161388
N-[[2-(cyclopropylmethoxy)-4-pyridinyl]methyl]-3-methyl-5-nitroimidazol-4-amine
CID 56784891
N-[[2-(cyclohexylmethoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62387269
3-[3-(cyclobutylmethoxy)-5-fluorophenyl]-1-methylpyrazol-5-amine
CID 117440376

Frequently Asked Questions

What is the IUPAC name of 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one?
The IUPAC name of 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one (CID 126954677) is 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one.
What is the SMILES notation for 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one?
The canonical SMILES for 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one is Cn1cnc(OCC2CCC2)cc1=O.
What is the InChIKey of 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one?
The InChIKey is JSTAZYDMZIBVMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-12-7-11-9(5-10(12)13)14-6-8-3-2-4-8/h5,7-8H,2-4,6H2,1H3.
What are the key properties of 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one?
6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one has a molecular weight of 194.23 g/mol, XLogP of 0.96, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclobutylmethoxy)-3-methylpyrimidin-4-one is sourced from PubChem (CID 126954677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).