2,2-di(cyclobutyl)azetidine

C11H19N — CID 130529151

IUPAC2,2-di(cyclobutyl)azetidine
SMILESC1CC(C2(C3CCC3)CCN2)C1
InChIInChI=1S/C11H19N/c1-3-9(4-1)11(7-8-12-11)10-5-2-6-10/h9-10,12H,1-8H2
InChIKeyPHYKZQGICOHPAI-UHFFFAOYSA-N
MW165.28 g/mol
LogP2.32
Rot. Bonds2

About 2,2-di(cyclobutyl)azetidine

2,2-di(cyclobutyl)azetidine (PubChem CID 130529151) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 2,2-di(cyclobutyl)azetidine.

Molecular Properties

Compound Name2,2-di(cyclobutyl)azetidine
PubChem CID130529151
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name2,2-di(cyclobutyl)azetidine
SMILESC1CC(C2(C3CCC3)CCN2)C1
InChIInChI=1S/C11H19N/c1-3-9(4-1)11(7-8-12-11)10-5-2-6-10/h9-10,12H,1-8H2
InChIKeyPHYKZQGICOHPAI-UHFFFAOYSA-N
XLogP2.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-di(cyclobutyl)azetidine?
The IUPAC name of 2,2-di(cyclobutyl)azetidine (CID 130529151) is 2,2-di(cyclobutyl)azetidine.
What is the SMILES notation for 2,2-di(cyclobutyl)azetidine?
The canonical SMILES for 2,2-di(cyclobutyl)azetidine is C1CC(C2(C3CCC3)CCN2)C1.
What is the InChIKey of 2,2-di(cyclobutyl)azetidine?
The InChIKey is PHYKZQGICOHPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-3-9(4-1)11(7-8-12-11)10-5-2-6-10/h9-10,12H,1-8H2.
What are the key properties of 2,2-di(cyclobutyl)azetidine?
2,2-di(cyclobutyl)azetidine has a molecular weight of 165.28 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-di(cyclobutyl)azetidine is sourced from PubChem (CID 130529151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).