3-(1-cyclobutyl-1-fluoroethyl)azetidine

C9H16FN — CID 105430754

IUPAC3-(1-cyclobutyl-1-fluoroethyl)azetidine
SMILESCC(F)(C1CCC1)C1CNC1
InChIInChI=1S/C9H16FN/c1-9(10,7-3-2-4-7)8-5-11-6-8/h7-8,11H,2-6H2,1H3
InChIKeyUUPGIDZBFSPKSQ-UHFFFAOYSA-N
MW157.23 g/mol
LogP1.73
Rot. Bonds2

About 3-(1-cyclobutyl-1-fluoroethyl)azetidine

3-(1-cyclobutyl-1-fluoroethyl)azetidine (PubChem CID 105430754) has the molecular formula C9H16FN and a molecular weight of 157.23 g/mol. Its IUPAC name is 3-(1-cyclobutyl-1-fluoroethyl)azetidine.

Molecular Properties

Compound Name3-(1-cyclobutyl-1-fluoroethyl)azetidine
PubChem CID105430754
Molecular FormulaC9H16FN
Molecular Weight157.23 g/mol
Exact Mass157.13
IUPAC Name3-(1-cyclobutyl-1-fluoroethyl)azetidine
SMILESCC(F)(C1CCC1)C1CNC1
InChIInChI=1S/C9H16FN/c1-9(10,7-3-2-4-7)8-5-11-6-8/h7-8,11H,2-6H2,1H3
InChIKeyUUPGIDZBFSPKSQ-UHFFFAOYSA-N
XLogP1.73
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.23
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclobutyl-1-fluoroethyl)azetidine?
The IUPAC name of 3-(1-cyclobutyl-1-fluoroethyl)azetidine (CID 105430754) is 3-(1-cyclobutyl-1-fluoroethyl)azetidine.
What is the SMILES notation for 3-(1-cyclobutyl-1-fluoroethyl)azetidine?
The canonical SMILES for 3-(1-cyclobutyl-1-fluoroethyl)azetidine is CC(F)(C1CCC1)C1CNC1.
What is the InChIKey of 3-(1-cyclobutyl-1-fluoroethyl)azetidine?
The InChIKey is UUPGIDZBFSPKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FN/c1-9(10,7-3-2-4-7)8-5-11-6-8/h7-8,11H,2-6H2,1H3.
What are the key properties of 3-(1-cyclobutyl-1-fluoroethyl)azetidine?
3-(1-cyclobutyl-1-fluoroethyl)azetidine has a molecular weight of 157.23 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclobutyl-1-fluoroethyl)azetidine is sourced from PubChem (CID 105430754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).