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

C12H18N2O — CID 115769665

IUPAC1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone
SMILESCCc1nccn1CC(=O)C1CCCC1
InChIInChI=1S/C12H18N2O/c1-2-12-13-7-8-14(12)9-11(15)10-5-3-4-6-10/h7-8,10H,2-6,9H2,1H3
InChIKeyCZMXXZUCJJICBE-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.20
Rot. Bonds4

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

1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone (PubChem CID 115769665) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone.

Molecular Properties

Compound Name1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone
PubChem CID115769665
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone
SMILESCCc1nccn1CC(=O)C1CCCC1
InChIInChI=1S/C12H18N2O/c1-2-12-13-7-8-14(12)9-11(15)10-5-3-4-6-10/h7-8,10H,2-6,9H2,1H3
InChIKeyCZMXXZUCJJICBE-UHFFFAOYSA-N
XLogP2.20
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-2-(2-methylimidazol-1-yl)ethanone
CID 115919041
1-cyclobutyl-2-(1-ethylimidazol-2-yl)ethanone
CID 79744561
cyclohexyl-[4-[(2-ethylimidazol-1-yl)methyl]piperidin-1-yl]methanone
CID 90492732
2-amino-2-cyclopropyl-3-(2-ethylimidazol-1-yl)propanamide
CID 63920700
2-(2-ethylimidazol-1-yl)-N-[(1R,2S,3R)-2-hydroxy-3-pyrrolidin-1-ylcyclopentyl]-N-methylacetamide
CID 110127449
2-[2-(2-ethylimidazol-1-yl)ethyl]-1-methylpiperidine
CID 107914179
N-(cyclopentylmethyl)-2-(2-ethylimidazol-1-yl)ethanamine
CID 62567010
1-(cyclopropylmethyl)-2-ethylimidazole
CID 63811309
N-cyclohexyl-2-[4-[(2-ethylimidazol-1-yl)methyl]piperidin-1-yl]acetamide
CID 90493994
2-cyclohexyl-1-[4-[(2-ethylimidazol-1-yl)methyl]piperidin-1-yl]ethanone
CID 90492733
2-cyclopropyl-3-(2-ethylimidazol-1-yl)-2-(propylamino)propanamide
CID 63919908
3-(2-ethylimidazol-1-yl)-1-[2-(4-fluorophenyl)piperidin-1-yl]propan-1-one
CID 70721497

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone?
The IUPAC name of 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone (CID 115769665) is 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone.
What is the SMILES notation for 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone?
The canonical SMILES for 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone is CCc1nccn1CC(=O)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone?
The InChIKey is CZMXXZUCJJICBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-2-12-13-7-8-14(12)9-11(15)10-5-3-4-6-10/h7-8,10H,2-6,9H2,1H3.
What are the key properties of 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone?
1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone has a molecular weight of 206.29 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(2-ethylimidazol-1-yl)ethanone is sourced from PubChem (CID 115769665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).