1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol

C13H22O — CID 70541588

IUPAC1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol
SMILESC=CCC1(O)C2(C)CCCC1(C)CC2
InChIInChI=1S/C13H22O/c1-4-6-13(14)11(2)7-5-8-12(13,3)10-9-11/h4,14H,1,5-10H2,2-3H3
InChIKeyUMUGHUDVVIKYFR-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.28
Rot. Bonds2

About 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol

1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol (PubChem CID 70541588) has the molecular formula C13H22O and a molecular weight of 194.32 g/mol. Its IUPAC name is 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol.

Molecular Properties

Compound Name1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol
PubChem CID70541588
Molecular FormulaC13H22O
Molecular Weight194.32 g/mol
Exact Mass194.17
IUPAC Name1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol
SMILESC=CCC1(O)C2(C)CCCC1(C)CC2
InChIInChI=1S/C13H22O/c1-4-6-13(14)11(2)7-5-8-12(13,3)10-9-11/h4,14H,1,5-10H2,2-3H3
InChIKeyUMUGHUDVVIKYFR-UHFFFAOYSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Spirojatamol
CID 11053257
Bicyclo[2.2.1]heptan-2-ol, 2-allyl-1,7,7-trimethyl-
CID 4918971
(1R,2R,4R)-1,7,7-Trimethyl-2-(2-propen-1-yl)bicyclo(2.2.1)heptan-2-ol
CID 1506016
2-But-3-en-2-yl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
CID 68836192
(1S,5S,9R)-9-Isopropyl-1-methyl-6-methylenespiro[4.5]decan-1-ol
CID 14587119
(4R,5R,7S)-4-methyl-10-methylidene-7-propan-2-ylspiro[4.5]decan-4-ol
CID 10977052
(1R,2R,4S)-3,3,7,7-tetramethyl-2-prop-2-enylbicyclo[2.2.1]heptan-2-ol
CID 134894978
2-[(2R)-but-3-en-2-yl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
CID 134964190
1,9-Dibutyltricyclo[4.2.1.12,5]dec-3-en-9-ol
CID 134973221
(1R,2S,4R)-2-[(2R)-but-3-en-2-yl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
CID 11492181
1-Allyl-2,2,6,6-tetramethylcyclohexan-1-ol
CID 13782562
alpha-Allyl-alpha,3,3-trimethyl-2-norbornane-methanol
CID 21319797

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol?
The IUPAC name of 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol (CID 70541588) is 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol.
What is the SMILES notation for 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol?
The canonical SMILES for 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol is C=CCC1(O)C2(C)CCCC1(C)CC2.
What is the InChIKey of 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol?
The InChIKey is UMUGHUDVVIKYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O/c1-4-6-13(14)11(2)7-5-8-12(13,3)10-9-11/h4,14H,1,5-10H2,2-3H3.
What are the key properties of 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol?
1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol has a molecular weight of 194.32 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol is sourced from PubChem (CID 70541588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).