trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol

C10H18O — CID 130927341

IUPACtrans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol
SMILESC=C(C)[C@H]1CC(C)(C)C[C@@H]1O
InChIInChI=1S/C10H18O/c1-7(2)8-5-10(3,4)6-9(8)11/h8-9,11H,1,5-6H2,2-4H3/t8-,9+/m1/s1
InChIKeyOQIXVZYDCWMLSZ-BDAKNGLRSA-N
MW154.25 g/mol
LogP2.36
Rot. Bonds1

About trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol

trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol (PubChem CID 130927341) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol
PubChem CID130927341
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Nametrans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol
SMILESC=C(C)[C@H]1CC(C)(C)C[C@@H]1O
InChIInChI=1S/C10H18O/c1-7(2)8-5-10(3,4)6-9(8)11/h8-9,11H,1,5-6H2,2-4H3/t8-,9+/m1/s1
InChIKeyOQIXVZYDCWMLSZ-BDAKNGLRSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-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

2-(4,4-dimethyl-2-prop-1-en-2-ylcyclopentyl)acetaldehyde
CID 72819468
(1S,2S,4R,5S)-1-methyl-4-prop-1-en-2-ylbicyclo[3.1.0]hexan-2-ol
CID 130990108
1-[(1S,2R)-2-acetyl-4,4-dimethylcyclopentyl]ethanone
CID 164669308
cis-(1R,2R)-2-prop-1-en-2-ylcyclopentan-1-ol
CID 12033954
4,5-bis(prop-1-en-2-yl)cyclohexene
CID 168967391
7-hydroxy-4,4a-dimethyl-6-prop-1-en-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalen-2-one
CID 78173699
2-prop-1-en-2-ylcyclododecan-1-ol
CID 141054945
(2R,3S)-2-prop-1-en-2-ylspiro[3.5]nonan-3-ol
CID 102075660
cis-(1R,2R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;cis-(1S,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;cis-(2R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;(1R,2R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;(1R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;(2R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol;trans-(1R,5R)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol
CID 161332933
trans-(2R,5S)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol
CID 130904144
trans-(1S,5S)-5-methyl-2-prop-1-en-2-ylcyclohexan-1-ol
CID 10909792
3-butan-2-yl-5,5-dimethylcyclohexane-1,2-diol
CID 123875963

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol?
The IUPAC name of trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol (CID 130927341) is trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol.
What is the SMILES notation for trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol?
The canonical SMILES for trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol is C=C(C)[C@H]1CC(C)(C)C[C@@H]1O.
What is the InChIKey of trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol?
The InChIKey is OQIXVZYDCWMLSZ-BDAKNGLRSA-N. The full InChI is InChI=1S/C10H18O/c1-7(2)8-5-10(3,4)6-9(8)11/h8-9,11H,1,5-6H2,2-4H3/t8-,9+/m1/s1.
What are the key properties of trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol?
trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2R)-4,4-dimethyl-2-prop-1-en-2-ylcyclopentan-1-ol is sourced from PubChem (CID 130927341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).