1-ethenyl-3,5-dimethylpiperidin-2-one

C9H15NO — CID 22171759

IUPAC1-ethenyl-3,5-dimethylpiperidin-2-one
SMILESC=CN1CC(C)CC(C)C1=O
InChIInChI=1S/C9H15NO/c1-4-10-6-7(2)5-8(3)9(10)11/h4,7-8H,1,5-6H2,2-3H3
InChIKeyZOZQTPQWSYVFPY-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.63
Rot. Bonds1

About 1-ethenyl-3,5-dimethylpiperidin-2-one

1-ethenyl-3,5-dimethylpiperidin-2-one (PubChem CID 22171759) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 1-ethenyl-3,5-dimethylpiperidin-2-one.

Molecular Properties

Compound Name1-ethenyl-3,5-dimethylpiperidin-2-one
PubChem CID22171759
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name1-ethenyl-3,5-dimethylpiperidin-2-one
SMILESC=CN1CC(C)CC(C)C1=O
InChIInChI=1S/C9H15NO/c1-4-10-6-7(2)5-8(3)9(10)11/h4,7-8H,1,5-6H2,2-3H3
InChIKeyZOZQTPQWSYVFPY-UHFFFAOYSA-N
XLogP1.63
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Piperidinone, 1,5-dimethyl-
CID 159027
1,3-Dimethyl-2-piperidinone
CID 160591
N-Vinylpiperidone
CID 10129953
1,3,5-Trimethylpiperidone
CID 13700379
1-Ethenyl-3-ethylpiperidin-2-one
CID 18512696
1-Ethenyl-3-methylpiperidin-2-one
CID 22134023
1-Ethenyl-4-methylpiperidin-2-one
CID 22134034
1-Ethenyl-4,5-dimethylpiperidin-2-one
CID 167194082
1-Ethyl-3-methylpiperidin-2-one
CID 12366574
1-Butyl-3-methylpiperidin-2-one
CID 14202331
1-Ethenyl-5-ethylpiperidin-2-one
CID 18512690
1-Ethenyl-4-ethylpiperidin-2-one
CID 18512695

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3,5-dimethylpiperidin-2-one?
The IUPAC name of 1-ethenyl-3,5-dimethylpiperidin-2-one (CID 22171759) is 1-ethenyl-3,5-dimethylpiperidin-2-one.
What is the SMILES notation for 1-ethenyl-3,5-dimethylpiperidin-2-one?
The canonical SMILES for 1-ethenyl-3,5-dimethylpiperidin-2-one is C=CN1CC(C)CC(C)C1=O.
What is the InChIKey of 1-ethenyl-3,5-dimethylpiperidin-2-one?
The InChIKey is ZOZQTPQWSYVFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-10-6-7(2)5-8(3)9(10)11/h4,7-8H,1,5-6H2,2-3H3.
What are the key properties of 1-ethenyl-3,5-dimethylpiperidin-2-one?
1-ethenyl-3,5-dimethylpiperidin-2-one has a molecular weight of 153.22 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3,5-dimethylpiperidin-2-one is sourced from PubChem (CID 22171759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).