4-(4-methylpent-3-enyl)cyclohexen-1-ol

C12H20O — CID 102261794

IUPAC4-(4-methylpent-3-enyl)cyclohexen-1-ol
SMILESCC(C)=CCCC1CC=C(O)CC1
InChIInChI=1S/C12H20O/c1-10(2)4-3-5-11-6-8-12(13)9-7-11/h4,8,11,13H,3,5-7,9H2,1-2H3
InChIKeyGYNNGYHOYLEIQV-UHFFFAOYSA-N
MW180.29 g/mol
LogP3.97
Rot. Bonds3

About 4-(4-methylpent-3-enyl)cyclohexen-1-ol

4-(4-methylpent-3-enyl)cyclohexen-1-ol (PubChem CID 102261794) has the molecular formula C12H20O and a molecular weight of 180.29 g/mol. Its IUPAC name is 4-(4-methylpent-3-enyl)cyclohexen-1-ol.

Molecular Properties

Compound Name4-(4-methylpent-3-enyl)cyclohexen-1-ol
PubChem CID102261794
Molecular FormulaC12H20O
Molecular Weight180.29 g/mol
Exact Mass180.15
IUPAC Name4-(4-methylpent-3-enyl)cyclohexen-1-ol
SMILESCC(C)=CCCC1CC=C(O)CC1
InChIInChI=1S/C12H20O/c1-10(2)4-3-5-11-6-8-12(13)9-7-11/h4,8,11,13H,3,5-7,9H2,1-2H3
InChIKeyGYNNGYHOYLEIQV-UHFFFAOYSA-N
XLogP3.97
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 53.97
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

(1S)-4-[2-(4-hydroxycyclohex-3-en-1-yl)ethyl]cyclohexa-2,4-dien-1-ol
CID 134219968
1-[[4-(4-methylpent-3-enyl)cyclohexyl]methoxy]-4-[2-[4-(4-methylpentyl)cyclohex-3-en-1-yl]ethyl]benzene
CID 22085426
(4S)-1-[(3E)-4,8-dimethylnona-3,7-dienyl]-4-methylcyclohexene
CID 169000974
4-(ethylamino)cyclohexen-1-ol
CID 89171409
4-fluorocyclohexen-1-ol
CID 89060796
5-methyl-1-[(1S)-4-methylcyclohex-3-en-1-yl]hex-4-en-1-ol
CID 122522261
(1R)-N,4-dimethyl-N-(4-methylpent-3-enyl)cyclohex-3-en-1-amine
CID 657066
[(4R)-4-propylcyclohexen-1-yl]methanol
CID 163783069
4-hex-4-enyl-1-methylcyclohexene
CID 173420371
3-(4,8-dimethylnona-3,7-dienyl)-4-hydroxyoxolan-2-one
CID 71412265
2-methylbenzenesulfonic acid;[4-(4-methylpent-3-enyl)cyclohex-3-en-1-yl]methanol
CID 86747414
2-(4-methoxycyclohex-3-en-1-yl)ethanol
CID 19370217

Frequently Asked Questions

What is the IUPAC name of 4-(4-methylpent-3-enyl)cyclohexen-1-ol?
The IUPAC name of 4-(4-methylpent-3-enyl)cyclohexen-1-ol (CID 102261794) is 4-(4-methylpent-3-enyl)cyclohexen-1-ol.
What is the SMILES notation for 4-(4-methylpent-3-enyl)cyclohexen-1-ol?
The canonical SMILES for 4-(4-methylpent-3-enyl)cyclohexen-1-ol is CC(C)=CCCC1CC=C(O)CC1.
What is the InChIKey of 4-(4-methylpent-3-enyl)cyclohexen-1-ol?
The InChIKey is GYNNGYHOYLEIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O/c1-10(2)4-3-5-11-6-8-12(13)9-7-11/h4,8,11,13H,3,5-7,9H2,1-2H3.
What are the key properties of 4-(4-methylpent-3-enyl)cyclohexen-1-ol?
4-(4-methylpent-3-enyl)cyclohexen-1-ol has a molecular weight of 180.29 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylpent-3-enyl)cyclohexen-1-ol is sourced from PubChem (CID 102261794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).