3,3-difluoro-1-(2-methoxyethyl)azetidine

C6H11F2NO — CID 122269382

IUPAC3,3-difluoro-1-(2-methoxyethyl)azetidine
SMILESCOCCN1CC(F)(F)C1
InChIInChI=1S/C6H11F2NO/c1-10-3-2-9-4-6(7,8)5-9/h2-5H2,1H3
InChIKeyOCSCIRNXDKPIKN-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.58
Rot. Bonds3

About 3,3-difluoro-1-(2-methoxyethyl)azetidine

3,3-difluoro-1-(2-methoxyethyl)azetidine (PubChem CID 122269382) has the molecular formula C6H11F2NO and a molecular weight of 151.16 g/mol. Its IUPAC name is 3,3-difluoro-1-(2-methoxyethyl)azetidine.

Molecular Properties

Compound Name3,3-difluoro-1-(2-methoxyethyl)azetidine
PubChem CID122269382
Molecular FormulaC6H11F2NO
Molecular Weight151.16 g/mol
Exact Mass151.08
IUPAC Name3,3-difluoro-1-(2-methoxyethyl)azetidine
SMILESCOCCN1CC(F)(F)C1
InChIInChI=1S/C6H11F2NO/c1-10-3-2-9-4-6(7,8)5-9/h2-5H2,1H3
InChIKeyOCSCIRNXDKPIKN-UHFFFAOYSA-N
XLogP0.58
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-(2-methoxyethyl)azetidine?
The IUPAC name of 3,3-difluoro-1-(2-methoxyethyl)azetidine (CID 122269382) is 3,3-difluoro-1-(2-methoxyethyl)azetidine.
What is the SMILES notation for 3,3-difluoro-1-(2-methoxyethyl)azetidine?
The canonical SMILES for 3,3-difluoro-1-(2-methoxyethyl)azetidine is COCCN1CC(F)(F)C1.
What is the InChIKey of 3,3-difluoro-1-(2-methoxyethyl)azetidine?
The InChIKey is OCSCIRNXDKPIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2NO/c1-10-3-2-9-4-6(7,8)5-9/h2-5H2,1H3.
What are the key properties of 3,3-difluoro-1-(2-methoxyethyl)azetidine?
3,3-difluoro-1-(2-methoxyethyl)azetidine has a molecular weight of 151.16 g/mol, XLogP of 0.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-(2-methoxyethyl)azetidine is sourced from PubChem (CID 122269382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).