3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine

C10H15F2NO — CID 169104715

IUPAC3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine
SMILESFC1(F)C2CC(COC3CNC3)CC21
InChIInChI=1S/C10H15F2NO/c11-10(12)8-1-6(2-9(8)10)5-14-7-3-13-4-7/h6-9,13H,1-5H2
InChIKeyAKSIBYVCJYZDHU-UHFFFAOYSA-N
MW203.23 g/mol
LogP1.27
Rot. Bonds3

About 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine

3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine (PubChem CID 169104715) has the molecular formula C10H15F2NO and a molecular weight of 203.23 g/mol. Its IUPAC name is 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine.

Molecular Properties

Compound Name3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine
PubChem CID169104715
Molecular FormulaC10H15F2NO
Molecular Weight203.23 g/mol
Exact Mass203.11
IUPAC Name3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine
SMILESFC1(F)C2CC(COC3CNC3)CC21
InChIInChI=1S/C10H15F2NO/c11-10(12)8-1-6(2-9(8)10)5-14-7-3-13-4-7/h6-9,13H,1-5H2
InChIKeyAKSIBYVCJYZDHU-UHFFFAOYSA-N
XLogP1.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.23
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine?
The IUPAC name of 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine (CID 169104715) is 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine.
What is the SMILES notation for 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine?
The canonical SMILES for 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine is FC1(F)C2CC(COC3CNC3)CC21.
What is the InChIKey of 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine?
The InChIKey is AKSIBYVCJYZDHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2NO/c11-10(12)8-1-6(2-9(8)10)5-14-7-3-13-4-7/h6-9,13H,1-5H2.
What are the key properties of 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine?
3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine has a molecular weight of 203.23 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6,6-difluoro-3-bicyclo[3.1.0]hexanyl)methoxy]azetidine is sourced from PubChem (CID 169104715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).