(3S)-3-hydroxycyclopentene-1-carboxylic acid

C6H8O3 — CID 11579122

IUPAC(3S)-3-hydroxycyclopentene-1-carboxylic acid
SMILESO=C(O)C1=C[C@@H](O)CC1
InChIInChI=1S/C6H8O3/c7-5-2-1-4(3-5)6(8)9/h3,5,7H,1-2H2,(H,8,9)/t5-/m0/s1
InChIKeyVKJGQKRRULDFCI-YFKPBYRVSA-N
MW128.13 g/mol
LogP0.15
Rot. Bonds1

About (3S)-3-hydroxycyclopentene-1-carboxylic acid

(3S)-3-hydroxycyclopentene-1-carboxylic acid (PubChem CID 11579122) has the molecular formula C6H8O3 and a molecular weight of 128.13 g/mol. Its IUPAC name is (3S)-3-hydroxycyclopentene-1-carboxylic acid.

Molecular Properties

Compound Name(3S)-3-hydroxycyclopentene-1-carboxylic acid
PubChem CID11579122
Molecular FormulaC6H8O3
Molecular Weight128.13 g/mol
Exact Mass128.05
IUPAC Name(3S)-3-hydroxycyclopentene-1-carboxylic acid
SMILESO=C(O)C1=C[C@@H](O)CC1
InChIInChI=1S/C6H8O3/c7-5-2-1-4(3-5)6(8)9/h3,5,7H,1-2H2,(H,8,9)/t5-/m0/s1
InChIKeyVKJGQKRRULDFCI-YFKPBYRVSA-N
XLogP0.15
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (3S)-3-hydroxycyclopentene-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

Kbr2kpc2U5
CID 11550012
3-Hydroxycyclopent-1-enecarboxylic acid
CID 21750168
Sodium 3-hydroxycyclopentene-1-carboxylate
CID 73346311
3-Hydroxycyclohex-1-ene-1-carboxylic acid
CID 55299090
3-Hydroxy-3-tritiocyclopentene-1-carboxylic acid
CID 72714102
5-Hydroxy-8-oxo-6-octenoic acid
CID 9942261
3-Hydroxy-2-methylcyclopent-1-ene-1-carboxylic acid
CID 137654346
3-Hydroxy-2-prop-2-enylcyclopentene-1-carboxylic acid
CID 137656458
Aspilactonol A
CID 139586154
4-Hydroxy-cyclopent-2-ene-1,2-dicarboxylic acid
CID 23143950
(3R,4S)-3,4-dihydroxycyclohexene-1-carboxylic acid
CID 42626781
Dechlorotrichodenone C
CID 10877123

Frequently Asked Questions

What is the IUPAC name of (3S)-3-hydroxycyclopentene-1-carboxylic acid?
The IUPAC name of (3S)-3-hydroxycyclopentene-1-carboxylic acid (CID 11579122) is (3S)-3-hydroxycyclopentene-1-carboxylic acid.
What is the SMILES notation for (3S)-3-hydroxycyclopentene-1-carboxylic acid?
The canonical SMILES for (3S)-3-hydroxycyclopentene-1-carboxylic acid is O=C(O)C1=C[C@@H](O)CC1.
What is the InChIKey of (3S)-3-hydroxycyclopentene-1-carboxylic acid?
The InChIKey is VKJGQKRRULDFCI-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H8O3/c7-5-2-1-4(3-5)6(8)9/h3,5,7H,1-2H2,(H,8,9)/t5-/m0/s1.
What are the key properties of (3S)-3-hydroxycyclopentene-1-carboxylic acid?
(3S)-3-hydroxycyclopentene-1-carboxylic acid has a molecular weight of 128.13 g/mol, XLogP of 0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-hydroxycyclopentene-1-carboxylic acid is sourced from PubChem (CID 11579122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).