7-(cyclopenten-1-yl)heptanoic acid

C12H20O2 — CID 23035884

IUPAC7-(cyclopenten-1-yl)heptanoic acid
SMILESO=C(O)CCCCCCC1=CCCC1
InChIInChI=1S/C12H20O2/c13-12(14)10-4-2-1-3-7-11-8-5-6-9-11/h8H,1-7,9-10H2,(H,13,14)
InChIKeyRQUIUZWLNMSDHI-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.52
Rot. Bonds7

About 7-(cyclopenten-1-yl)heptanoic acid

7-(cyclopenten-1-yl)heptanoic acid (PubChem CID 23035884) has the molecular formula C12H20O2 and a molecular weight of 196.29 g/mol. Its IUPAC name is 7-(cyclopenten-1-yl)heptanoic acid.

Molecular Properties

Compound Name7-(cyclopenten-1-yl)heptanoic acid
PubChem CID23035884
Molecular FormulaC12H20O2
Molecular Weight196.29 g/mol
Exact Mass196.15
IUPAC Name7-(cyclopenten-1-yl)heptanoic acid
SMILESO=C(O)CCCCCCC1=CCCC1
InChIInChI=1S/C12H20O2/c13-12(14)10-4-2-1-3-7-11-8-5-6-9-11/h8H,1-7,9-10H2,(H,13,14)
InChIKeyRQUIUZWLNMSDHI-UHFFFAOYSA-N
XLogP3.52
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 7-(cyclopenten-1-yl)heptanoic 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-[4-(cyclopenten-1-yl)butyl]cyclopentene
CID 10420053
3-[2-(cyclopenten-1-yl)ethylamino]propanoic acid
CID 106173967
4-[2-(cyclohexen-1-yl)ethylamino]butanoic acid
CID 62324339
4-(cyclohexen-1-yl)butanamide
CID 165359181
9-amino-1-(cyclohexen-1-yl)nonan-4-one
CID 71055210
5-[2-(cyclopenten-1-yl)ethylcarbamoylamino]-5-oxopentanoic acid
CID 106177489
7-(3-oxocyclopenten-1-yl)heptanoic acid
CID 22444568
5-[2-(cyclohexen-1-yl)ethylamino]-5-oxopentanoic acid
CID 2932918
1-(4-bromobutyl)cyclopentene
CID 14243708
6-[[2-(cyclohexen-1-yl)acetyl]amino]hexanoic acid
CID 63565537
1-octylcyclohexene
CID 519088
1-hexylcycloheptene
CID 15587826

Frequently Asked Questions

What is the IUPAC name of 7-(cyclopenten-1-yl)heptanoic acid?
The IUPAC name of 7-(cyclopenten-1-yl)heptanoic acid (CID 23035884) is 7-(cyclopenten-1-yl)heptanoic acid.
What is the SMILES notation for 7-(cyclopenten-1-yl)heptanoic acid?
The canonical SMILES for 7-(cyclopenten-1-yl)heptanoic acid is O=C(O)CCCCCCC1=CCCC1.
What is the InChIKey of 7-(cyclopenten-1-yl)heptanoic acid?
The InChIKey is RQUIUZWLNMSDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2/c13-12(14)10-4-2-1-3-7-11-8-5-6-9-11/h8H,1-7,9-10H2,(H,13,14).
What are the key properties of 7-(cyclopenten-1-yl)heptanoic acid?
7-(cyclopenten-1-yl)heptanoic acid has a molecular weight of 196.29 g/mol, XLogP of 3.52, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(cyclopenten-1-yl)heptanoic acid is sourced from PubChem (CID 23035884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).