4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid

C14H25NO2 — CID 18446261

IUPAC4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid
SMILESO=C(O)C1CC(CCCC2CCCC2)CCN1
InChIInChI=1S/C14H25NO2/c16-14(17)13-10-12(8-9-15-13)7-3-6-11-4-1-2-5-11/h11-13,15H,1-10H2,(H,16,17)
InChIKeyYBLFQMNGXUYGCB-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.80
Rot. Bonds5

About 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid

4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid (PubChem CID 18446261) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid
PubChem CID18446261
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid
SMILESO=C(O)C1CC(CCCC2CCCC2)CCN1
InChIInChI=1S/C14H25NO2/c16-14(17)13-10-12(8-9-15-13)7-3-6-11-4-1-2-5-11/h11-13,15H,1-10H2,(H,16,17)
InChIKeyYBLFQMNGXUYGCB-UHFFFAOYSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid?
The IUPAC name of 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid (CID 18446261) is 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid.
What is the SMILES notation for 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid?
The canonical SMILES for 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid is O=C(O)C1CC(CCCC2CCCC2)CCN1.
What is the InChIKey of 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid?
The InChIKey is YBLFQMNGXUYGCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c16-14(17)13-10-12(8-9-15-13)7-3-6-11-4-1-2-5-11/h11-13,15H,1-10H2,(H,16,17).
What are the key properties of 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid?
4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid has a molecular weight of 239.36 g/mol, XLogP of 2.80, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylpropyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 18446261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).