(1R)-3-methylidenecyclopentane-1-carboxylic acid

C7H10O2 — CID 90130625

IUPAC(1R)-3-methylidenecyclopentane-1-carboxylic acid
SMILESC=C1CC[C@@H](C(=O)O)C1
InChIInChI=1S/C7H10O2/c1-5-2-3-6(4-5)7(8)9/h6H,1-4H2,(H,8,9)/t6-/m1/s1
InChIKeyKXWCTOFUEWEPHD-ZCFIWIBFSA-N
MW126.16 g/mol
LogP1.43
Rot. Bonds1

About (1R)-3-methylidenecyclopentane-1-carboxylic acid

(1R)-3-methylidenecyclopentane-1-carboxylic acid (PubChem CID 90130625) has the molecular formula C7H10O2 and a molecular weight of 126.16 g/mol. Its IUPAC name is (1R)-3-methylidenecyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name(1R)-3-methylidenecyclopentane-1-carboxylic acid
PubChem CID90130625
Molecular FormulaC7H10O2
Molecular Weight126.16 g/mol
Exact Mass126.07
IUPAC Name(1R)-3-methylidenecyclopentane-1-carboxylic acid
SMILESC=C1CC[C@@H](C(=O)O)C1
InChIInChI=1S/C7H10O2/c1-5-2-3-6(4-5)7(8)9/h6H,1-4H2,(H,8,9)/t6-/m1/s1
InChIKeyKXWCTOFUEWEPHD-ZCFIWIBFSA-N
XLogP1.43
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1R)-3-methylidenecyclopentane-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

Frequently Asked Questions

What is the IUPAC name of (1R)-3-methylidenecyclopentane-1-carboxylic acid?
The IUPAC name of (1R)-3-methylidenecyclopentane-1-carboxylic acid (CID 90130625) is (1R)-3-methylidenecyclopentane-1-carboxylic acid.
What is the SMILES notation for (1R)-3-methylidenecyclopentane-1-carboxylic acid?
The canonical SMILES for (1R)-3-methylidenecyclopentane-1-carboxylic acid is C=C1CC[C@@H](C(=O)O)C1.
What is the InChIKey of (1R)-3-methylidenecyclopentane-1-carboxylic acid?
The InChIKey is KXWCTOFUEWEPHD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H10O2/c1-5-2-3-6(4-5)7(8)9/h6H,1-4H2,(H,8,9)/t6-/m1/s1.
What are the key properties of (1R)-3-methylidenecyclopentane-1-carboxylic acid?
(1R)-3-methylidenecyclopentane-1-carboxylic acid has a molecular weight of 126.16 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-methylidenecyclopentane-1-carboxylic acid is sourced from PubChem (CID 90130625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).