(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol

C10H18O — CID 11819249

IUPAC(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol
SMILESC/C=C1\CC(C)(C)CCC1O
InChIInChI=1S/C10H18O/c1-4-8-7-10(2,3)6-5-9(8)11/h4,9,11H,5-7H2,1-3H3/b8-4+
InChIKeyXCBZRGVZHRCADI-XBXARRHUSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds

About (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol

(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol (PubChem CID 11819249) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol
PubChem CID11819249
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol
SMILESC/C=C1\CC(C)(C)CCC1O
InChIInChI=1S/C10H18O/c1-4-8-7-10(2,3)6-5-9(8)11/h4,9,11H,5-7H2,1-3H3/b8-4+
InChIKeyXCBZRGVZHRCADI-XBXARRHUSA-N
XLogP2.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1R,2Z)-2-ethylidenecyclobutan-1-ol
CID 174038570
2-ethylidenecyclopentan-1-ol
CID 72740887
(3Z)-3-(methoxymethylidene)-1,1-dimethyl-4-propan-2-ylcyclohexane
CID 177406107
lithium [(2E)-2-ethylidene-4,4-dimethylcyclohexyl]oxycarbonyl-phenylazanide
CID 10401370
(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol
CID 101374109
(3Z)-3-ethylidene-1,5,5-trimethylbicyclo[2.1.1]hexane
CID 173027480
cis-(1R,2S)-2-amino-4,4-dimethylcyclohexan-1-ol
CID 55291251
lithium [(2E)-2-ethylidene-4,4-dimethylcyclopentyl]oxycarbonyl-phenylazanide
CID 10355489
6,6-dimethyl-1,2,3,4,5,7-hexahydroinden-2-ol
CID 130128432
octyl (2Z)-2-(2-hydroxy-4,4-dimethylcyclopentylidene)acetate
CID 101395815
N-[(1Z,3E)-3-[(4,4-dimethylcyclohexyl)oxymethyl]penta-1,3-dienyl]methanimine;ethane
CID 144881902
[(2E)-2-benzylidene-4,4-dimethylcyclohexyl] N-phenylcarbamate
CID 10359964

Frequently Asked Questions

What is the IUPAC name of (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol?
The IUPAC name of (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol (CID 11819249) is (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol.
What is the SMILES notation for (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol?
The canonical SMILES for (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol is C/C=C1\CC(C)(C)CCC1O.
What is the InChIKey of (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol?
The InChIKey is XCBZRGVZHRCADI-XBXARRHUSA-N. The full InChI is InChI=1S/C10H18O/c1-4-8-7-10(2,3)6-5-9(8)11/h4,9,11H,5-7H2,1-3H3/b8-4+.
What are the key properties of (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol?
(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.50, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol is sourced from PubChem (CID 11819249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).