3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol

C13H26O — CID 91288894

IUPAC3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol
SMILESCCC1CCC(CC(C)C)C(O)C1C
InChIInChI=1S/C13H26O/c1-5-11-6-7-12(8-9(2)3)13(14)10(11)4/h9-14H,5-8H2,1-4H3
InChIKeyYXFFODKGCOQQTM-UHFFFAOYSA-N
MW198.35 g/mol
LogP3.47
Rot. Bonds3

About 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol

3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol (PubChem CID 91288894) has the molecular formula C13H26O and a molecular weight of 198.35 g/mol. Its IUPAC name is 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol
PubChem CID91288894
Molecular FormulaC13H26O
Molecular Weight198.35 g/mol
Exact Mass198.20
IUPAC Name3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol
SMILESCCC1CCC(CC(C)C)C(O)C1C
InChIInChI=1S/C13H26O/c1-5-11-6-7-12(8-9(2)3)13(14)10(11)4/h9-14H,5-8H2,1-4H3
InChIKeyYXFFODKGCOQQTM-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-amino-3-ethyl-2-methylcyclohexan-1-ol
CID 156818437
1,3-diethyl-2-methylcyclopentane
CID 123589151
cis-(1S,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 173447814
trans-(1R,2R)-1-ethyl-2-(2-methylpropyl)cyclopropane
CID 168764244
1-ethyl-2-methyl-5-(2-methylpropyl)cycloheptane
CID 123952928
2-(2-methylpropyl)-1,2,3,4,5,5a,6,7,8,9,10,10a-dodecahydroheptalene-1,10-diol
CID 170527501
(1S,2R,3R)-1-ethyl-2,3-dimethylcyclopentane
CID 6431519
cis-(2S,5S)-2-ethyl-5-methylcyclopentan-1-ol;ethane
CID 142059714
2-ethyl-4-(2-methylpropyl)cyclohexan-1-ol;2-ethyl-5-(2-methylpropyl)cyclohexan-1-ol
CID 158656489
3-ethyl-2-methyl-N-propan-2-ylcyclopentan-1-amine
CID 64921128
2-ethyl-6-propan-2-ylcyclohexan-1-ol
CID 58534394
trans-(1R,2R)-1,2-diethylcyclobutane
CID 59110889

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol?
The IUPAC name of 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol (CID 91288894) is 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol.
What is the SMILES notation for 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol?
The canonical SMILES for 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol is CCC1CCC(CC(C)C)C(O)C1C.
What is the InChIKey of 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol?
The InChIKey is YXFFODKGCOQQTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O/c1-5-11-6-7-12(8-9(2)3)13(14)10(11)4/h9-14H,5-8H2,1-4H3.
What are the key properties of 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol?
3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol has a molecular weight of 198.35 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-methyl-6-(2-methylpropyl)cyclohexan-1-ol is sourced from PubChem (CID 91288894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).