3-cyclobutylpiperidine-4-carboxylic acid

C10H17NO2 — CID 84769140

IUPAC3-cyclobutylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCNCC1C1CCC1
InChIInChI=1S/C10H17NO2/c12-10(13)8-4-5-11-6-9(8)7-2-1-3-7/h7-9,11H,1-6H2,(H,12,13)
InChIKeyWXRMFEFBXVWZJJ-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.10
Rot. Bonds2

About 3-cyclobutylpiperidine-4-carboxylic acid

3-cyclobutylpiperidine-4-carboxylic acid (PubChem CID 84769140) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-cyclobutylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name3-cyclobutylpiperidine-4-carboxylic acid
PubChem CID84769140
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name3-cyclobutylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCNCC1C1CCC1
InChIInChI=1S/C10H17NO2/c12-10(13)8-4-5-11-6-9(8)7-2-1-3-7/h7-9,11H,1-6H2,(H,12,13)
InChIKeyWXRMFEFBXVWZJJ-UHFFFAOYSA-N
XLogP1.10
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutylpiperidine-4-carboxylic acid?
The IUPAC name of 3-cyclobutylpiperidine-4-carboxylic acid (CID 84769140) is 3-cyclobutylpiperidine-4-carboxylic acid.
What is the SMILES notation for 3-cyclobutylpiperidine-4-carboxylic acid?
The canonical SMILES for 3-cyclobutylpiperidine-4-carboxylic acid is O=C(O)C1CCNCC1C1CCC1.
What is the InChIKey of 3-cyclobutylpiperidine-4-carboxylic acid?
The InChIKey is WXRMFEFBXVWZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c12-10(13)8-4-5-11-6-9(8)7-2-1-3-7/h7-9,11H,1-6H2,(H,12,13).
What are the key properties of 3-cyclobutylpiperidine-4-carboxylic acid?
3-cyclobutylpiperidine-4-carboxylic acid has a molecular weight of 183.25 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutylpiperidine-4-carboxylic acid is sourced from PubChem (CID 84769140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).