1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone

C13H20O — CID 130578340

IUPAC1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone
SMILESCC1(CC(=O)C2=CCCC2)CCCC1
InChIInChI=1S/C13H20O/c1-13(8-4-5-9-13)10-12(14)11-6-2-3-7-11/h6H,2-5,7-10H2,1H3
InChIKeyYMGMKISGLKUIKD-UHFFFAOYSA-N
MW192.30 g/mol
LogP3.64
Rot. Bonds3

About 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone

1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone (PubChem CID 130578340) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone
PubChem CID130578340
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone
SMILESCC1(CC(=O)C2=CCCC2)CCCC1
InChIInChI=1S/C13H20O/c1-13(8-4-5-9-13)10-12(14)11-6-2-3-7-11/h6H,2-5,7-10H2,1H3
InChIKeyYMGMKISGLKUIKD-UHFFFAOYSA-N
XLogP3.64
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(aminomethyl)cyclohexyl]-1-(cyclohexen-1-yl)ethanone
CID 106655745
1-(cyclopenten-1-yl)tridecan-1-one
CID 103448100
1-(cyclopenten-1-yl)-2-(4-methylphenyl)ethanone
CID 62080493
1-(cyclopenten-1-yl)-4,4-dimethylhexan-1-one
CID 129257201
cyclohexen-1-yl-[1-(dimethylamino)cyclopentyl]methanone
CID 106652002
cyclohexen-1-yl-(1-hydroxycyclopentyl)methanone
CID 106652335
N-(1-methylcyclopropyl)cyclohexene-1-carboxamide
CID 130625889
1-(cyclopenten-1-yl)-5,5,5-trifluoropentan-1-one
CID 103448187
3-amino-1-(cyclohexen-1-yl)-3-methylbutan-1-one
CID 106655429
cycloocten-1-yl-(3-methylpyrrolidin-3-yl)methanone
CID 106655318
1-(cyclohepten-1-yl)-3-methylhexan-1-one
CID 103450521
3-cyclohexyl-1-(cyclopenten-1-yl)propan-1-one
CID 62078476

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone?
The IUPAC name of 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone (CID 130578340) is 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone.
What is the SMILES notation for 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone?
The canonical SMILES for 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone is CC1(CC(=O)C2=CCCC2)CCCC1.
What is the InChIKey of 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone?
The InChIKey is YMGMKISGLKUIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O/c1-13(8-4-5-9-13)10-12(14)11-6-2-3-7-11/h6H,2-5,7-10H2,1H3.
What are the key properties of 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone?
1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone has a molecular weight of 192.30 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)-2-(1-methylcyclopentyl)ethanone is sourced from PubChem (CID 130578340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).