1-cyclobutylpiperidine-4-carboxylic acid

C10H17NO2 — CID 53440464

IUPAC1-cyclobutylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C2CCC2)CC1
InChIInChI=1S/C10H17NO2/c12-10(13)8-4-6-11(7-5-8)9-2-1-3-9/h8-9H,1-7H2,(H,12,13)
InChIKeyGTIVRTAYDFGYFI-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.34
Rot. Bonds2

About 1-cyclobutylpiperidine-4-carboxylic acid

1-cyclobutylpiperidine-4-carboxylic acid (PubChem CID 53440464) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is 1-cyclobutylpiperidine-4-carboxylic acid.

Molecular Properties

Compound Name1-cyclobutylpiperidine-4-carboxylic acid
PubChem CID53440464
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name1-cyclobutylpiperidine-4-carboxylic acid
SMILESO=C(O)C1CCN(C2CCC2)CC1
InChIInChI=1S/C10H17NO2/c12-10(13)8-4-6-11(7-5-8)9-2-1-3-9/h8-9H,1-7H2,(H,12,13)
InChIKeyGTIVRTAYDFGYFI-UHFFFAOYSA-N
XLogP1.34
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclobutylpiperidine-4-carboxylic acid?
The IUPAC name of 1-cyclobutylpiperidine-4-carboxylic acid (CID 53440464) is 1-cyclobutylpiperidine-4-carboxylic acid.
What is the SMILES notation for 1-cyclobutylpiperidine-4-carboxylic acid?
The canonical SMILES for 1-cyclobutylpiperidine-4-carboxylic acid is O=C(O)C1CCN(C2CCC2)CC1.
What is the InChIKey of 1-cyclobutylpiperidine-4-carboxylic acid?
The InChIKey is GTIVRTAYDFGYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO2/c12-10(13)8-4-6-11(7-5-8)9-2-1-3-9/h8-9H,1-7H2,(H,12,13).
What are the key properties of 1-cyclobutylpiperidine-4-carboxylic acid?
1-cyclobutylpiperidine-4-carboxylic acid has a molecular weight of 183.25 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutylpiperidine-4-carboxylic acid is sourced from PubChem (CID 53440464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).