(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol

C12H22O — CID 130127211

IUPAC(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol
SMILESC=CC1(C(C)C)CCCC1(C)CO
InChIInChI=1S/C12H22O/c1-5-12(10(2)3)8-6-7-11(12,4)9-13/h5,10,13H,1,6-9H2,2-4H3
InChIKeyKRWPZRWTCAVXPD-UHFFFAOYSA-N
MW182.31 g/mol
LogP3.00
Rot. Bonds3

About (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol

(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol (PubChem CID 130127211) has the molecular formula C12H22O and a molecular weight of 182.31 g/mol. Its IUPAC name is (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol.

Molecular Properties

Compound Name(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol
PubChem CID130127211
Molecular FormulaC12H22O
Molecular Weight182.31 g/mol
Exact Mass182.17
IUPAC Name(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol
SMILESC=CC1(C(C)C)CCCC1(C)CO
InChIInChI=1S/C12H22O/c1-5-12(10(2)3)8-6-7-11(12,4)9-13/h5,10,13H,1,6-9H2,2-4H3
InChIKeyKRWPZRWTCAVXPD-UHFFFAOYSA-N
XLogP3.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol 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

(1,2,2-trimethylcyclopentyl)methanol
CID 12003447
trans-(1S,2S)-2-(hydroxymethyl)-2-methyl-1-prop-2-enylcyclohexan-1-ol
CID 71726289
2-(hydroxymethyl)-1,2-dimethylcyclohexan-1-ol
CID 12590009
(1-but-3-en-2-yl-4-methylpiperidin-4-yl)methanol
CID 127000307
(1-methylcyclododecyl)methanol
CID 70130772
(2,2-dichloro-1-methylcyclopropyl)methanol
CID 13018564
(2R)-2-[(2S,5S)-5-ethenyl-5-methyloxolan-2-yl]propan-1-ol
CID 162923110
(2-propan-2-ylpyrrolidin-2-yl)methanol
CID 84648893
1,5-dimethyl-8-prop-2-enylbicyclo[3.2.1]octan-8-ol
CID 70541588
buta-1,3-dien-2-ol;1-butan-2-yl-1,2,2-trimethylcyclopentane;ethane
CID 143365281
1-ethenyl-1-methyl-2-propan-2-yl-4-prop-1-en-2-ylcyclohexane
CID 100977936
5-(1,2,2-trimethylcyclopentyl)pentan-1-ol
CID 67793892

Frequently Asked Questions

What is the IUPAC name of (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol?
The IUPAC name of (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol (CID 130127211) is (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol.
What is the SMILES notation for (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol?
The canonical SMILES for (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol is C=CC1(C(C)C)CCCC1(C)CO.
What is the InChIKey of (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol?
The InChIKey is KRWPZRWTCAVXPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O/c1-5-12(10(2)3)8-6-7-11(12,4)9-13/h5,10,13H,1,6-9H2,2-4H3.
What are the key properties of (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol?
(2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol has a molecular weight of 182.31 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenyl-1-methyl-2-propan-2-ylcyclopentyl)methanol is sourced from PubChem (CID 130127211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).