2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane

C14H28 — CID 123981733

IUPAC2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane
SMILESCCC1C(C)CC(C(C)(C)CC)C1C
InChIInChI=1S/C14H28/c1-7-12-10(3)9-13(11(12)4)14(5,6)8-2/h10-13H,7-9H2,1-6H3
InChIKeyXPXQRISCWNJABR-UHFFFAOYSA-N
MW196.38 g/mol
LogP4.74
Rot. Bonds3

About 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane

2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane (PubChem CID 123981733) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane.

Molecular Properties

Compound Name2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane
PubChem CID123981733
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane
SMILESCCC1C(C)CC(C(C)(C)CC)C1C
InChIInChI=1S/C14H28/c1-7-12-10(3)9-13(11(12)4)14(5,6)8-2/h10-13H,7-9H2,1-6H3
InChIKeyXPXQRISCWNJABR-UHFFFAOYSA-N
XLogP4.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.38
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-1-methyl-3-[2-methyl-1-(2-methyl-4-propan-2-ylcyclobutyl)propan-2-yl]cyclobutane
CID 123987093
2-(2-methylbutan-2-yl)bicyclo[3.1.1]heptane
CID 123158926
1,2-diethyl-3-[1-(2-ethyl-3-methylcyclopropyl)-2-methylpropan-2-yl]cyclopropane
CID 123380149
2-[(1S,2S)-2-methylcyclopropyl]propan-2-ol
CID 167340222
5-chloro-2-ethyl-1,3-dimethylcyclohexane
CID 163493383
1-ethyl-3-(2-methylbutan-2-yl)cyclopentane
CID 123901390
(3S,4R,5R)-3-ethyl-4,5-dimethyloxane
CID 118946155
(1S,2R,3R,4R)-2-ethyl-3-(iodomethyl)-1,4-dimethylcyclopentane
CID 58644913
4-ethyl-3,5-dimethyloxane
CID 91432465
(1S,7S,8S)-8-ethyl-3,4,5,7-tetramethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ol
CID 71133313
1,2-diethyl-3,4-dimethylcyclobutane
CID 91590074
cis-(2R,3S)-1-ethyl-2,3-dimethylcyclopropane
CID 59954456

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane?
The IUPAC name of 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane (CID 123981733) is 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane.
What is the SMILES notation for 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane?
The canonical SMILES for 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane is CCC1C(C)CC(C(C)(C)CC)C1C.
What is the InChIKey of 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane?
The InChIKey is XPXQRISCWNJABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-7-12-10(3)9-13(11(12)4)14(5,6)8-2/h10-13H,7-9H2,1-6H3.
What are the key properties of 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane?
2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane has a molecular weight of 196.38 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,3-dimethyl-4-(2-methylbutan-2-yl)cyclopentane is sourced from PubChem (CID 123981733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).