(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol

C10H16O — CID 138606754

IUPAC(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol
SMILESC=C[C@@H]1CC(O)C=CC1(C)C
InChIInChI=1S/C10H16O/c1-4-8-7-9(11)5-6-10(8,2)3/h4-6,8-9,11H,1,7H2,2-3H3/t8-,9?/m1/s1
InChIKeyYGXYKCBXCNTFGR-VEDVMXKPSA-N
MW152.24 g/mol
LogP2.14
Rot. Bonds1

About (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol

(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol (PubChem CID 138606754) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol.

Molecular Properties

Compound Name(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol
PubChem CID138606754
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol
SMILESC=C[C@@H]1CC(O)C=CC1(C)C
InChIInChI=1S/C10H16O/c1-4-8-7-9(11)5-6-10(8,2)3/h4-6,8-9,11H,1,7H2,2-3H3/t8-,9?/m1/s1
InChIKeyYGXYKCBXCNTFGR-VEDVMXKPSA-N
XLogP2.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.14
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

1-methylcyclopent-4-ene-1,3-diol
CID 14083582
(1'R,5R,5'R)-5'-ethenyl-7-methoxy-2,6-dimethylspiro[3,4-dihydro-1H-2-benzazepine-5,4'-cyclohex-2-ene]-1'-ol
CID 89221080
(1R,2S,5R)-5-ethenyl-1-methylcyclopentane-1,2-diol
CID 130456562
2-ethenylcyclopropan-1-ol
CID 54500145
5-ethenyl-1,4-dimethylbicyclo[2.2.1]hept-2-ene
CID 139783357
(1R,3aR,4S,6R,8aS)-1,4-dimethyl-2,3,3a,4,5,6-hexahydroazulene-1,6,8a-triol
CID 139191420
(1S,2S,5S)-2-ethenyl-6,6-dimethylbicyclo[3.1.1]hept-3-en-2-ol
CID 101408374
(3aR,7aR)-3,6,7,7a-tetrahydro-2H-1-benzofuran-3a,6-diol
CID 44567078
(14S)-9-methoxy-4,7-dimethyl-4-prop-2-enyl-11-oxa-4λ4-thiatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol
CID 163865814
(2-ethenyl-1-methylcyclobutyl)silane
CID 173136645
5-ethenyl-3,3-dimethylcyclohexan-1-ol
CID 58534468
trans-(1R,2S)-2-ethenyl-1-methylcyclopentane-1-carbonyl chloride
CID 131853161

Frequently Asked Questions

What is the IUPAC name of (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol?
The IUPAC name of (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol (CID 138606754) is (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol.
What is the SMILES notation for (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol?
The canonical SMILES for (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol is C=C[C@@H]1CC(O)C=CC1(C)C.
What is the InChIKey of (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol?
The InChIKey is YGXYKCBXCNTFGR-VEDVMXKPSA-N. The full InChI is InChI=1S/C10H16O/c1-4-8-7-9(11)5-6-10(8,2)3/h4-6,8-9,11H,1,7H2,2-3H3/t8-,9?/m1/s1.
What are the key properties of (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol?
(5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-ethenyl-4,4-dimethylcyclohex-2-en-1-ol is sourced from PubChem (CID 138606754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).