1,6-dimethyl-4-propan-2-ylpyridin-2-one

C10H15NO — CID 125450408

IUPAC1,6-dimethyl-4-propan-2-ylpyridin-2-one
SMILESCc1cc(C(C)C)cc(=O)n1C
InChIInChI=1S/C10H15NO/c1-7(2)9-5-8(3)11(4)10(12)6-9/h5-7H,1-4H3
InChIKeyUXDASWPMFCUYIG-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.82
Rot. Bonds1

About 1,6-dimethyl-4-propan-2-ylpyridin-2-one

1,6-dimethyl-4-propan-2-ylpyridin-2-one (PubChem CID 125450408) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1,6-dimethyl-4-propan-2-ylpyridin-2-one.

Molecular Properties

Compound Name1,6-dimethyl-4-propan-2-ylpyridin-2-one
PubChem CID125450408
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1,6-dimethyl-4-propan-2-ylpyridin-2-one
SMILESCc1cc(C(C)C)cc(=O)n1C
InChIInChI=1S/C10H15NO/c1-7(2)9-5-8(3)11(4)10(12)6-9/h5-7H,1-4H3
InChIKeyUXDASWPMFCUYIG-UHFFFAOYSA-N
XLogP1.82
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,5,6-Trimethyl-2-pyridone
CID 12735847
Acetyl-4,6-dimethylpyridin-2(1 h)-one
CID 20254841
1-ethyl-4,6-dimethyl-2(1H)-pyridone
CID 21538594
1,6-Dimethyl-4-(trifluoromethyl)pyridin-2(1H)-one
CID 22382014
1,4-dimethyl-6-(trifluoromethyl)-1H-pyridin-2-one
CID 22382050
1,6-Dimethyl-3-propan-2-yl-4-(trifluoromethyl)pyridin-2-one
CID 89458525
5-Fluoro-1,4,6-trimethylpyridin-2-one
CID 140313172
4-(1,1-Difluoroethyl)-1,6-dimethyl-3-propan-2-ylpyridin-2-one
CID 145615182
3-But-3-en-2-yl-1,6-dimethyl-4-(trifluoromethyl)pyridin-2-one
CID 145615234
6-Fluoro-2-methyl-1-propan-2-ylisoquinolin-3-one
CID 146498738
4,6-Dimethyl-5-propan-2-yl-1-(2,2,2-trifluoroethyl)pyridin-2-one
CID 146552143
8-Propan-2-yl-2-(trifluoromethyl)quinolizin-4-one
CID 156440410

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethyl-4-propan-2-ylpyridin-2-one?
The IUPAC name of 1,6-dimethyl-4-propan-2-ylpyridin-2-one (CID 125450408) is 1,6-dimethyl-4-propan-2-ylpyridin-2-one.
What is the SMILES notation for 1,6-dimethyl-4-propan-2-ylpyridin-2-one?
The canonical SMILES for 1,6-dimethyl-4-propan-2-ylpyridin-2-one is Cc1cc(C(C)C)cc(=O)n1C.
What is the InChIKey of 1,6-dimethyl-4-propan-2-ylpyridin-2-one?
The InChIKey is UXDASWPMFCUYIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-7(2)9-5-8(3)11(4)10(12)6-9/h5-7H,1-4H3.
What are the key properties of 1,6-dimethyl-4-propan-2-ylpyridin-2-one?
1,6-dimethyl-4-propan-2-ylpyridin-2-one has a molecular weight of 165.24 g/mol, XLogP of 1.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethyl-4-propan-2-ylpyridin-2-one is sourced from PubChem (CID 125450408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).