(2R)-4-cyclobutyl-1,2-dimethylpiperidine

C11H21N — CID 171414314

IUPAC(2R)-4-cyclobutyl-1,2-dimethylpiperidine
SMILESC[C@@H]1CC(C2CCC2)CCN1C
InChIInChI=1S/C11H21N/c1-9-8-11(6-7-12(9)2)10-4-3-5-10/h9-11H,3-8H2,1-2H3/t9-,11?/m1/s1
InChIKeyULEYQFAOIHBGFJ-BFHBGLAWSA-N
MW167.30 g/mol
LogP2.52
Rot. Bonds1

About (2R)-4-cyclobutyl-1,2-dimethylpiperidine

(2R)-4-cyclobutyl-1,2-dimethylpiperidine (PubChem CID 171414314) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is (2R)-4-cyclobutyl-1,2-dimethylpiperidine.

Molecular Properties

Compound Name(2R)-4-cyclobutyl-1,2-dimethylpiperidine
PubChem CID171414314
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name(2R)-4-cyclobutyl-1,2-dimethylpiperidine
SMILESC[C@@H]1CC(C2CCC2)CCN1C
InChIInChI=1S/C11H21N/c1-9-8-11(6-7-12(9)2)10-4-3-5-10/h9-11H,3-8H2,1-2H3/t9-,11?/m1/s1
InChIKeyULEYQFAOIHBGFJ-BFHBGLAWSA-N
XLogP2.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-4-cyclobutyl-1,2-dimethylpiperidine?
The IUPAC name of (2R)-4-cyclobutyl-1,2-dimethylpiperidine (CID 171414314) is (2R)-4-cyclobutyl-1,2-dimethylpiperidine.
What is the SMILES notation for (2R)-4-cyclobutyl-1,2-dimethylpiperidine?
The canonical SMILES for (2R)-4-cyclobutyl-1,2-dimethylpiperidine is C[C@@H]1CC(C2CCC2)CCN1C.
What is the InChIKey of (2R)-4-cyclobutyl-1,2-dimethylpiperidine?
The InChIKey is ULEYQFAOIHBGFJ-BFHBGLAWSA-N. The full InChI is InChI=1S/C11H21N/c1-9-8-11(6-7-12(9)2)10-4-3-5-10/h9-11H,3-8H2,1-2H3/t9-,11?/m1/s1.
What are the key properties of (2R)-4-cyclobutyl-1,2-dimethylpiperidine?
(2R)-4-cyclobutyl-1,2-dimethylpiperidine has a molecular weight of 167.30 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-cyclobutyl-1,2-dimethylpiperidine is sourced from PubChem (CID 171414314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).