(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol

C10H18O — CID 101374109

IUPAC(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol
SMILESC/C=C1/CC[C@H](O)C(C)(C)C1
InChIInChI=1S/C10H18O/c1-4-8-5-6-9(11)10(2,3)7-8/h4,9,11H,5-7H2,1-3H3/b8-4-/t9-/m0/s1
InChIKeyJLYHLDJFTVPPIU-OTOXVQDCSA-N
MW154.25 g/mol
LogP2.50
Rot. Bonds

About (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol

(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol (PubChem CID 101374109) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol
PubChem CID101374109
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol
SMILESC/C=C1/CC[C@H](O)C(C)(C)C1
InChIInChI=1S/C10H18O/c1-4-8-5-6-9(11)10(2,3)7-8/h4,9,11H,5-7H2,1-3H3/b8-4-/t9-/m0/s1
InChIKeyJLYHLDJFTVPPIU-OTOXVQDCSA-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

(3E)-1-ethenyl-3-ethylidenecyclopentane
CID 155632567
2-but-3-enyl-3-hydroxy-2-methylcyclopentan-1-one
CID 85299271
5-(4-ethylidenecyclohexyl)-1-methylcyclohexa-3,5-diene-1,3-dicarboxylic acid
CID 152620296
N-cyclohexyl-4-ethylidenecyclohexan-1-amine
CID 176909478
(2E)-2-ethylidene-4,4-dimethylcyclohexan-1-ol
CID 11819249
[(1S)-3-ethylidenecyclopentyl]methanol
CID 159536244
3-ethylidene-1-methyl-1-(4-methylpenta-1,3-dienyl)cyclohexane
CID 139973453
2-ethenyl-5-ethylideneoxane
CID 175709330
(1R)-3-(hydroxymethyl)-2,2,4-trimethylcyclohex-3-en-1-ol
CID 130719581
(4E)-2-ethoxy-4-ethylidenecyclohexan-1-ol
CID 118659504
(5Z)-5-ethylidene-2-propan-2-yloxycyclohexan-1-ol
CID 118659400
(1R,2Z)-2-ethylidenecyclobutan-1-ol
CID 174038570

Frequently Asked Questions

What is the IUPAC name of (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol?
The IUPAC name of (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol (CID 101374109) is (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol is C/C=C1/CC[C@H](O)C(C)(C)C1.
What is the InChIKey of (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol?
The InChIKey is JLYHLDJFTVPPIU-OTOXVQDCSA-N. The full InChI is InChI=1S/C10H18O/c1-4-8-5-6-9(11)10(2,3)7-8/h4,9,11H,5-7H2,1-3H3/b8-4-/t9-/m0/s1.
What are the key properties of (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol?
(1S,4Z)-4-ethylidene-2,2-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 (1S,4Z)-4-ethylidene-2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 101374109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).