1-ethyl-3-(2-methylbutan-2-yl)cyclopentane

C12H24 — CID 123901390

IUPAC1-ethyl-3-(2-methylbutan-2-yl)cyclopentane
SMILESCCC1CCC(C(C)(C)CC)C1
InChIInChI=1S/C12H24/c1-5-10-7-8-11(9-10)12(3,4)6-2/h10-11H,5-9H2,1-4H3
InChIKeyUWFKRTXPQSDCOL-UHFFFAOYSA-N
MW168.32 g/mol
LogP4.25
Rot. Bonds3

About 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane

1-ethyl-3-(2-methylbutan-2-yl)cyclopentane (PubChem CID 123901390) has the molecular formula C12H24 and a molecular weight of 168.32 g/mol. Its IUPAC name is 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane.

Molecular Properties

Compound Name1-ethyl-3-(2-methylbutan-2-yl)cyclopentane
PubChem CID123901390
Molecular FormulaC12H24
Molecular Weight168.32 g/mol
Exact Mass168.19
IUPAC Name1-ethyl-3-(2-methylbutan-2-yl)cyclopentane
SMILESCCC1CCC(C(C)(C)CC)C1
InChIInChI=1S/C12H24/c1-5-10-7-8-11(9-10)12(3,4)6-2/h10-11H,5-9H2,1-4H3
InChIKeyUWFKRTXPQSDCOL-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.32
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bis(1-tert-butyl-3-ethylcyclopentane);carbanide;iron(2+)
CID 162292801
1-ethyl-3-(2-methylhex-5-en-2-yl)cyclopentane
CID 163864927
1,3-diethylcyclopentane
CID 530396
1-tert-butyl-4-(2-methylbutan-2-yl)cyclohexane
CID 57162506
1-(2,2-dimethylbutyl)-3-ethylcyclopentane
CID 91360585
1-ethyl-4-(2,4,4-trimethylpentan-2-yl)cyclohexane
CID 142995371
2-(4-ethylpiperidin-1-yl)-N-methyl-4-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 63470296
cis-(1R,4R)-1-ethyl-4-[2-[(1S,3R)-3-ethylcyclopentyl]propan-2-yl]-2-methylcyclopentane
CID 149008004
2-(aminomethyl)-N-(cyclopropylmethyl)-N-methyl-5-(2-methylbutan-2-yl)cyclohexan-1-amine
CID 54883914
N-tert-butyl-3-(4-ethylcyclohexyl)-3-methylbutan-1-amine
CID 81023448
1,3-ditert-butyl-5-ethylcyclohexane
CID 123167626
1,4-diethylcyclohexane;1-methyl-4-[2-(4-methylcyclohexyl)propan-2-yl]cyclohexane
CID 163450163

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane?
The IUPAC name of 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane (CID 123901390) is 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane.
What is the SMILES notation for 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane?
The canonical SMILES for 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane is CCC1CCC(C(C)(C)CC)C1.
What is the InChIKey of 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane?
The InChIKey is UWFKRTXPQSDCOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24/c1-5-10-7-8-11(9-10)12(3,4)6-2/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane?
1-ethyl-3-(2-methylbutan-2-yl)cyclopentane has a molecular weight of 168.32 g/mol, XLogP of 4.25, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-methylbutan-2-yl)cyclopentane is sourced from PubChem (CID 123901390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).