2-cyclopenta-2,4-dien-1-ylpropan-2-ol

C8H12O — CID 12574784

IUPAC2-cyclopenta-2,4-dien-1-ylpropan-2-ol
SMILESCC(C)(O)C1C=CC=C1
InChIInChI=1S/C8H12O/c1-8(2,9)7-5-3-4-6-7/h3-7,9H,1-2H3
InChIKeyRFJXQHFMZUYNMN-UHFFFAOYSA-N
MW124.18 g/mol
LogP1.50
Rot. Bonds1

About 2-cyclopenta-2,4-dien-1-ylpropan-2-ol

2-cyclopenta-2,4-dien-1-ylpropan-2-ol (PubChem CID 12574784) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is 2-cyclopenta-2,4-dien-1-ylpropan-2-ol.

Molecular Properties

Compound Name2-cyclopenta-2,4-dien-1-ylpropan-2-ol
PubChem CID12574784
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name2-cyclopenta-2,4-dien-1-ylpropan-2-ol
SMILESCC(C)(O)C1C=CC=C1
InChIInChI=1S/C8H12O/c1-8(2,9)7-5-3-4-6-7/h3-7,9H,1-2H3
InChIKeyRFJXQHFMZUYNMN-UHFFFAOYSA-N
XLogP1.50
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-cyclopenta-2,4-dien-1-ylpropan-2-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

1-cyclopenta-2,4-dien-1-yl-1-phenylethanol
CID 12574787
3-cyclopenta-2,4-dien-1-yl-3-methoxy-2-methylbutan-2-ol;titanium(2+);dichloride
CID 174381252
2-cyclopenta-2,4-dien-1-ylpropan-2-yl hypobromite
CID 167432979
2-[(1R)-2-(2-hydroxypropan-2-yl)-3-methylcyclohexyl]propan-2-ol
CID 155621775
2-[2-(2-hydroxypropan-2-yl)cyclohexyl]propan-2-ol
CID 139609797
2-[(1S,2S)-2-methylcyclopropyl]propan-2-ol
CID 167340222
2-cyclopenta-2,4-dien-1-yl-4-phenylbut-3-yn-2-ol
CID 12977900
N-(2-cyclopenta-2,4-dien-1-ylpropan-2-yl)-2,2-dimethylpropanamide
CID 10856679
6-(2-hydroxypropan-2-yl)cyclohexa-2,4-dien-1-one
CID 141269706
5-(3-ethylpentan-3-yl)cyclopenta-1,3-diene
CID 141460457
(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)benzene
CID 141345975
diethyl 2-cyclopenta-2,4-dien-1-yl-2-methylpropanedioate
CID 101130490

Frequently Asked Questions

What is the IUPAC name of 2-cyclopenta-2,4-dien-1-ylpropan-2-ol?
The IUPAC name of 2-cyclopenta-2,4-dien-1-ylpropan-2-ol (CID 12574784) is 2-cyclopenta-2,4-dien-1-ylpropan-2-ol.
What is the SMILES notation for 2-cyclopenta-2,4-dien-1-ylpropan-2-ol?
The canonical SMILES for 2-cyclopenta-2,4-dien-1-ylpropan-2-ol is CC(C)(O)C1C=CC=C1.
What is the InChIKey of 2-cyclopenta-2,4-dien-1-ylpropan-2-ol?
The InChIKey is RFJXQHFMZUYNMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O/c1-8(2,9)7-5-3-4-6-7/h3-7,9H,1-2H3.
What are the key properties of 2-cyclopenta-2,4-dien-1-ylpropan-2-ol?
2-cyclopenta-2,4-dien-1-ylpropan-2-ol has a molecular weight of 124.18 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopenta-2,4-dien-1-ylpropan-2-ol is sourced from PubChem (CID 12574784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).