4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid

C11H17NO2 — CID 82934042

IUPAC4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid
SMILESO=C(O)C1C=CC(NC2CCCC2)C1
InChIInChI=1S/C11H17NO2/c13-11(14)8-5-6-10(7-8)12-9-3-1-2-4-9/h5-6,8-10,12H,1-4,7H2,(H,13,14)
InChIKeyXKXGNDUFYAJWTM-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.55
Rot. Bonds3

About 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid

4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid (PubChem CID 82934042) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid.

Molecular Properties

Compound Name4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid
PubChem CID82934042
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid
SMILESO=C(O)C1C=CC(NC2CCCC2)C1
InChIInChI=1S/C11H17NO2/c13-11(14)8-5-6-10(7-8)12-9-3-1-2-4-9/h5-6,8-10,12H,1-4,7H2,(H,13,14)
InChIKeyXKXGNDUFYAJWTM-UHFFFAOYSA-N
XLogP1.55
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(cyclohexylcarbamoylamino)cyclopent-2-ene-1-carboxylic acid
CID 79216512
4-(cyclooctanecarbonylamino)cyclopent-2-ene-1-carboxylic acid
CID 79209356
4-[(2-cyclohexylacetyl)amino]cyclopent-2-ene-1-carboxylic acid
CID 79208872
4-(3-cyclopentylpropanoylamino)cyclopent-2-ene-1-carboxylic acid
CID 79209129
4-(2-cyclopentylethylcarbamoylamino)cyclopent-2-ene-1-carboxylic acid
CID 79216844
3-(cyclopentylamino)cyclobutane-1-carboxylic acid
CID 117027696
4-(sulfamoylamino)cyclopent-2-ene-1-carboxylic acid
CID 114958954
4-[(2-methylpiperidine-1-carbonyl)amino]cyclopent-2-ene-1-carboxylic acid
CID 79216891
4-[[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl]amino]cyclopent-2-ene-1-carboxylic acid
CID 102727428
4-[(2-cyclopentylpyrrolidine-1-carbonyl)amino]cyclopent-2-ene-1-carboxylic acid
CID 79191673
3-(cyclopentylamino)cyclopentane-1-carboxylic acid
CID 82933431
4-[(3,3-dimethylcyclopentyl)carbamoylamino]cyclopent-2-ene-1-carboxylic acid
CID 114549159

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid?
The IUPAC name of 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid (CID 82934042) is 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid.
What is the SMILES notation for 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid?
The canonical SMILES for 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid is O=C(O)C1C=CC(NC2CCCC2)C1.
What is the InChIKey of 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid?
The InChIKey is XKXGNDUFYAJWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c13-11(14)8-5-6-10(7-8)12-9-3-1-2-4-9/h5-6,8-10,12H,1-4,7H2,(H,13,14).
What are the key properties of 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid?
4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid has a molecular weight of 195.26 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopentylamino)cyclopent-2-ene-1-carboxylic acid is sourced from PubChem (CID 82934042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).