ethane;2,3,5,6-tetramethylpyrimidin-4-one

C10H18N2O — CID 143247986

IUPACethane;2,3,5,6-tetramethylpyrimidin-4-one
SMILESCC.Cc1nc(C)n(C)c(=O)c1C
InChIInChI=1S/C8H12N2O.C2H6/c1-5-6(2)9-7(3)10(4)8(5)11;1-2/h1-4H3;1-2H3
InChIKeyYCVARCQOTTWBRT-UHFFFAOYSA-N
MW182.27 g/mol
LogP1.73
Rot. Bonds

About ethane;2,3,5,6-tetramethylpyrimidin-4-one

ethane;2,3,5,6-tetramethylpyrimidin-4-one (PubChem CID 143247986) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is ethane;2,3,5,6-tetramethylpyrimidin-4-one.

Molecular Properties

Compound Nameethane;2,3,5,6-tetramethylpyrimidin-4-one
PubChem CID143247986
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Nameethane;2,3,5,6-tetramethylpyrimidin-4-one
SMILESCC.Cc1nc(C)n(C)c(=O)c1C
InChIInChI=1S/C8H12N2O.C2H6/c1-5-6(2)9-7(3)10(4)8(5)11;1-2/h1-4H3;1-2H3
InChIKeyYCVARCQOTTWBRT-UHFFFAOYSA-N
XLogP1.73
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,3,5-Trimethyl-6-(trifluoromethyl)pyrimidin-4-one
CID 68986103
2-Ethyl-3,5-dimethyl-6-(trifluoromethyl)pyrimidin-4-one
CID 68986585
Iodomethane;2,3,5-trimethyl-6-(trifluoromethyl)pyrimidin-4-one
CID 68987480
3,6-Dimethyl-2-propan-2-ylpyrimidin-4-one
CID 13123700
3-Ethyl-6-methyl-2-propan-2-ylpyrimidin-4-one
CID 13123701
3,5,6-Trimethylpyrimidin-4-one
CID 13149274
2,3,5,6-Tetramethylpyrimidin-4-one
CID 13149275
6-[Di(propan-2-yl)amino]-2,3,5-trimethylpyrimidin-4-one
CID 18719748
2,3,6,7,9-Pentamethylpyrazino[1,2-a]pyrimidin-4-one
CID 20583166
3-Ethyl-2,5,6-trimethylpyrimidin-4-one
CID 22091870
5,6-Ditert-butyl-2,3-dimethylpyrimidin-4-one
CID 23592094
1,2,4-Trimethyl-6-oxopyrimidine-5-carbaldehyde
CID 53766616

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,5,6-tetramethylpyrimidin-4-one?
The IUPAC name of ethane;2,3,5,6-tetramethylpyrimidin-4-one (CID 143247986) is ethane;2,3,5,6-tetramethylpyrimidin-4-one.
What is the SMILES notation for ethane;2,3,5,6-tetramethylpyrimidin-4-one?
The canonical SMILES for ethane;2,3,5,6-tetramethylpyrimidin-4-one is CC.Cc1nc(C)n(C)c(=O)c1C.
What is the InChIKey of ethane;2,3,5,6-tetramethylpyrimidin-4-one?
The InChIKey is YCVARCQOTTWBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O.C2H6/c1-5-6(2)9-7(3)10(4)8(5)11;1-2/h1-4H3;1-2H3.
What are the key properties of ethane;2,3,5,6-tetramethylpyrimidin-4-one?
ethane;2,3,5,6-tetramethylpyrimidin-4-one has a molecular weight of 182.27 g/mol, XLogP of 1.73, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,5,6-tetramethylpyrimidin-4-one is sourced from PubChem (CID 143247986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).