3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid

C10H16O3 — CID 14134000

IUPAC3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid
SMILESC=C(C)C1CC(O)C(C)C1C(=O)O
InChIInChI=1S/C10H16O3/c1-5(2)7-4-8(11)6(3)9(7)10(12)13/h6-9,11H,1,4H2,2-3H3,(H,12,13)
InChIKeyDSYOZGYYCNQHLP-UHFFFAOYSA-N
MW184.23 g/mol
LogP1.28
Rot. Bonds2

About 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid

3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid (PubChem CID 14134000) has the molecular formula C10H16O3 and a molecular weight of 184.23 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid
PubChem CID14134000
Molecular FormulaC10H16O3
Molecular Weight184.23 g/mol
Exact Mass184.11
IUPAC Name3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid
SMILESC=C(C)C1CC(O)C(C)C1C(=O)O
InChIInChI=1S/C10H16O3/c1-5(2)7-4-8(11)6(3)9(7)10(12)13/h6-9,11H,1,4H2,2-3H3,(H,12,13)
InChIKeyDSYOZGYYCNQHLP-UHFFFAOYSA-N
XLogP1.28
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.23
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid 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

Cucurbic acid
CID 6123064
(+)-Cucurbic acid
CID 5281159
(E)-2-(3-Hydroxy-2-(pent-2-en-1-yl)cyclopentyl)acetic acid
CID 441565
7-Iso-cucurbic acid
CID 14262447
2-[(1R,2R,3R)-3-hydroxy-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid
CID 14262445
2-[(1R,2S,3S)-3-hydroxy-2-[(E)-pent-2-enyl]cyclopentyl]acetic acid
CID 86310507
2-[(1S,2S,3S)-3-hydroxy-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid
CID 92975784
methyl (1R,2S,3R,5R)-3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylate
CID 131177950
(+/-)-3-Hydroxy-2-(2-pentenyl)cyclopentaneacetic Acid
CID 4480500
2-[(1R,2S)-3-hydroxy-2-[(Z)-pent-2-enyl]cyclopentyl]acetic acid
CID 11171865
methyl 2-[(1R,2R,5R)-5-hydroxy-3,3-dimethyl-2-prop-2-enylcyclopentyl]acetate
CID 14482482
methyl (1S,2R,3S,5S)-3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylate
CID 45098915

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid?
The IUPAC name of 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid (CID 14134000) is 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid?
The canonical SMILES for 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid is C=C(C)C1CC(O)C(C)C1C(=O)O.
What is the InChIKey of 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid?
The InChIKey is DSYOZGYYCNQHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O3/c1-5(2)7-4-8(11)6(3)9(7)10(12)13/h6-9,11H,1,4H2,2-3H3,(H,12,13).
What are the key properties of 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid?
3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid has a molecular weight of 184.23 g/mol, XLogP of 1.28, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-5-prop-1-en-2-ylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 14134000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).