(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid

C10H16O2 — CID 124673165

IUPAC(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid
SMILESC=C1CC[C@@](CCC)(C(=O)O)C1
InChIInChI=1S/C10H16O2/c1-3-5-10(9(11)12)6-4-8(2)7-10/h2-7H2,1H3,(H,11,12)/t10-/m1/s1
InChIKeyGMAIFHFXGLLBIB-SNVBAGLBSA-N
MW168.24 g/mol
LogP2.60
Rot. Bonds3

About (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid

(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid (PubChem CID 124673165) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid
PubChem CID124673165
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid
SMILESC=C1CC[C@@](CCC)(C(=O)O)C1
InChIInChI=1S/C10H16O2/c1-3-5-10(9(11)12)6-4-8(2)7-10/h2-7H2,1H3,(H,11,12)/t10-/m1/s1
InChIKeyGMAIFHFXGLLBIB-SNVBAGLBSA-N
XLogP2.60
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1R)-3-methylidene-1-propylcyclopentane-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

1-propylcyclooctane-1-carboxylic acid
CID 80611944
1,1-dioxo-4-propylthiane-4-carboxylic acid
CID 118669196
3-hydroxy-3-methyl-1-propylcyclobutane-1-carboxylic acid
CID 115014004
4-propylpiperidine-1,4-dicarboxylic acid
CID 91190681
1-acetyl-4-propylpiperidine-4-carboxylic acid
CID 63125183
ethyl 1-(bromomethyl)-4-methylidenecyclohexane-1-carboxylate
CID 10015501
1-(2-methylprop-2-enyl)-4-propylpiperidine-4-carboxylic acid
CID 63126976
4-propyl-1-(pyrrolidine-1-carbonyl)piperidine-4-carboxylic acid
CID 63126397
1-(3-methylcyclopentyl)-3-propylpyrrolidine-3-carboxylic acid
CID 65068943
ethenyl 1-propylcyclopropane-1-carboxylate
CID 66748614
1-nonylcyclopropane-1-carboxylic acid
CID 54124337
1-(2-chloroprop-2-enyl)-3-propylpyrrolidine-3-carboxylic acid
CID 63148411

Frequently Asked Questions

What is the IUPAC name of (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid?
The IUPAC name of (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid (CID 124673165) is (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid.
What is the SMILES notation for (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid?
The canonical SMILES for (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid is C=C1CC[C@@](CCC)(C(=O)O)C1.
What is the InChIKey of (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid?
The InChIKey is GMAIFHFXGLLBIB-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H16O2/c1-3-5-10(9(11)12)6-4-8(2)7-10/h2-7H2,1H3,(H,11,12)/t10-/m1/s1.
What are the key properties of (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid?
(1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid has a molecular weight of 168.24 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-methylidene-1-propylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 124673165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).