(2-ethyl-3-methylpentyl)cyclohexane

C14H28 — CID 91213059

IUPAC(2-ethyl-3-methylpentyl)cyclohexane
SMILESCCC(C)C(CC)CC1CCCCC1
InChIInChI=1S/C14H28/c1-4-12(3)14(5-2)11-13-9-7-6-8-10-13/h12-14H,4-11H2,1-3H3
InChIKeyNRBMADVWQMCXGC-UHFFFAOYSA-N
MW196.38 g/mol
LogP5.03
Rot. Bonds5

About (2-ethyl-3-methylpentyl)cyclohexane

(2-ethyl-3-methylpentyl)cyclohexane (PubChem CID 91213059) has the molecular formula C14H28 and a molecular weight of 196.38 g/mol. Its IUPAC name is (2-ethyl-3-methylpentyl)cyclohexane.

Molecular Properties

Compound Name(2-ethyl-3-methylpentyl)cyclohexane
PubChem CID91213059
Molecular FormulaC14H28
Molecular Weight196.38 g/mol
Exact Mass196.22
IUPAC Name(2-ethyl-3-methylpentyl)cyclohexane
SMILESCCC(C)C(CC)CC1CCCCC1
InChIInChI=1S/C14H28/c1-4-12(3)14(5-2)11-13-9-7-6-8-10-13/h12-14H,4-11H2,1-3H3
InChIKeyNRBMADVWQMCXGC-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500196.38
LogP ≤ 55.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[2-(cyclopropylmethyl)-3-methylpentyl]cyclobutane
CID 57296236
1-cycloheptyl-3-ethylpentan-2-amine
CID 105014024
azane;2-methylbutylcyclohexane
CID 143986613
1-cyclopentyl-4-ethylhexane-2,5-diol
CID 103160935
2,3-dimethylbutylcyclodecane
CID 123220792
2-butan-2-ylhexylcyclopropane
CID 123731337
(1-cyclopentyl-3-methylpentan-2-yl)hydrazine
CID 105219565
bis(2-methylpropylcyclohexane);2-methylpropylcyclopentane
CID 159474199
2-[2-(cyclohexylmethyl)-3-methylpentyl]naphthalene
CID 57064736
2-ethoxypropylcyclohexane
CID 57126788
1-cyclobutyl-3-methylpentan-2-ol
CID 65459256
(4R)-3-ethyl-4-methylhexane
CID 59954491

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-3-methylpentyl)cyclohexane?
The IUPAC name of (2-ethyl-3-methylpentyl)cyclohexane (CID 91213059) is (2-ethyl-3-methylpentyl)cyclohexane.
What is the SMILES notation for (2-ethyl-3-methylpentyl)cyclohexane?
The canonical SMILES for (2-ethyl-3-methylpentyl)cyclohexane is CCC(C)C(CC)CC1CCCCC1.
What is the InChIKey of (2-ethyl-3-methylpentyl)cyclohexane?
The InChIKey is NRBMADVWQMCXGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28/c1-4-12(3)14(5-2)11-13-9-7-6-8-10-13/h12-14H,4-11H2,1-3H3.
What are the key properties of (2-ethyl-3-methylpentyl)cyclohexane?
(2-ethyl-3-methylpentyl)cyclohexane has a molecular weight of 196.38 g/mol, XLogP of 5.03, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-3-methylpentyl)cyclohexane is sourced from PubChem (CID 91213059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).