2-cyclobutylpiperidine

C9H17N — CID 3657540

IUPAC2-cyclobutylpiperidine
SMILESC1CCC(C2CCC2)NC1
InChIInChI=1S/C9H17N/c1-2-7-10-9(6-1)8-4-3-5-8/h8-10H,1-7H2
InChIKeyTTWXQGZANCNAFO-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.93
Rot. Bonds1

About 2-cyclobutylpiperidine

2-cyclobutylpiperidine (PubChem CID 3657540) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 2-cyclobutylpiperidine.

Molecular Properties

Compound Name2-cyclobutylpiperidine
PubChem CID3657540
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name2-cyclobutylpiperidine
SMILESC1CCC(C2CCC2)NC1
InChIInChI=1S/C9H17N/c1-2-7-10-9(6-1)8-4-3-5-8/h8-10H,1-7H2
InChIKeyTTWXQGZANCNAFO-UHFFFAOYSA-N
XLogP1.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutylpiperidine?
The IUPAC name of 2-cyclobutylpiperidine (CID 3657540) is 2-cyclobutylpiperidine.
What is the SMILES notation for 2-cyclobutylpiperidine?
The canonical SMILES for 2-cyclobutylpiperidine is C1CCC(C2CCC2)NC1.
What is the InChIKey of 2-cyclobutylpiperidine?
The InChIKey is TTWXQGZANCNAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-2-7-10-9(6-1)8-4-3-5-8/h8-10H,1-7H2.
What are the key properties of 2-cyclobutylpiperidine?
2-cyclobutylpiperidine has a molecular weight of 139.24 g/mol, XLogP of 1.93, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutylpiperidine is sourced from PubChem (CID 3657540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).