1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone

C11H16N2O — CID 115919041

IUPAC1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone
SMILESCc1nccn1CC(=O)C1CCCC1
InChIInChI=1S/C11H16N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3
InChIKeyWEBAMICNNDXOIA-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.95
Rot. Bonds3

About 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone

1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone (PubChem CID 115919041) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone
PubChem CID115919041
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone
SMILESCc1nccn1CC(=O)C1CCCC1
InChIInChI=1S/C11H16N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3
InChIKeyWEBAMICNNDXOIA-UHFFFAOYSA-N
XLogP1.95
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone
CID 115769665
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2-(2-methylimidazol-1-yl)acetic acid;zinc
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1-cyclobutyl-2-(4,5-dimethylimidazol-1-yl)ethanone
CID 131025389
2-(2-methylimidazol-1-yl)-1-[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone
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CID 79395102
4-methyl-1-(2-methylimidazol-1-yl)pent-3-en-2-one
CID 131186404
1-cyclobutyl-2-(1-ethylimidazol-2-yl)ethanone
CID 79744561
1-(2-cyclopentyl-2-oxoethyl)-4-methylpyridin-2-one
CID 104751405
methyl 1-[2-(2-methylimidazol-1-yl)ethyl]piperidine-2-carboxylate
CID 113330911
1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanol
CID 104753089
N-(2-cyclohexylpyrazol-3-yl)-2-(2-methylimidazol-1-yl)acetamide
CID 46997255

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone?
The IUPAC name of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone (CID 115919041) is 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone.
What is the SMILES notation for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone?
The canonical SMILES for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone is Cc1nccn1CC(=O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone?
The InChIKey is WEBAMICNNDXOIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-9-12-6-7-13(9)8-11(14)10-4-2-3-5-10/h6-7,10H,2-5,8H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone?
1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone has a molecular weight of 192.26 g/mol, XLogP of 1.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone is sourced from PubChem (CID 115919041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).