3-fluoro-1,3-dimethylazetidine

C5H10FN — CID 89296536

IUPAC3-fluoro-1,3-dimethylazetidine
SMILESCN1CC(C)(F)C1
InChIInChI=1S/C5H10FN/c1-5(6)3-7(2)4-5/h3-4H2,1-2H3
InChIKeyCTOOUTTXJCCPQY-UHFFFAOYSA-N
MW103.14 g/mol
LogP0.66
Rot. Bonds

About 3-fluoro-1,3-dimethylazetidine

3-fluoro-1,3-dimethylazetidine (PubChem CID 89296536) has the molecular formula C5H10FN and a molecular weight of 103.14 g/mol. Its IUPAC name is 3-fluoro-1,3-dimethylazetidine.

Molecular Properties

Compound Name3-fluoro-1,3-dimethylazetidine
PubChem CID89296536
Molecular FormulaC5H10FN
Molecular Weight103.14 g/mol
Exact Mass103.08
IUPAC Name3-fluoro-1,3-dimethylazetidine
SMILESCN1CC(C)(F)C1
InChIInChI=1S/C5H10FN/c1-5(6)3-7(2)4-5/h3-4H2,1-2H3
InChIKeyCTOOUTTXJCCPQY-UHFFFAOYSA-N
XLogP0.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.14
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Azetidine, N-methyl-
CID 138389
1,3-Dimethylazetidine
CID 535545
1,1-Dimethylazetidin-1-ium
CID 13827063
1,3,3-Trimethylazetidine
CID 18461781
1-(2,2-Dimethylpropyl)-3-fluoro-3-methylazetidine
CID 16083940
3-Methyl-1-(3,3,3-trifluoropropyl)azetidine
CID 57537414
1-(tert-Butyl)-3-fluoroazetidine
CID 57559167
1-(2,2-Dimethylpropyl)-3-fluoroazetidine
CID 57910765
3-Fluoro-1-propan-2-ylazetidine
CID 58030274
3-Fluoro-1-methyl-3-(trifluoromethyl)azetidine
CID 58544110
3-Fluoro-3-methyl-1-propan-2-ylazetidine
CID 58547266
3-Fluoro-1-methylazetidine
CID 59504989

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1,3-dimethylazetidine?
The IUPAC name of 3-fluoro-1,3-dimethylazetidine (CID 89296536) is 3-fluoro-1,3-dimethylazetidine.
What is the SMILES notation for 3-fluoro-1,3-dimethylazetidine?
The canonical SMILES for 3-fluoro-1,3-dimethylazetidine is CN1CC(C)(F)C1.
What is the InChIKey of 3-fluoro-1,3-dimethylazetidine?
The InChIKey is CTOOUTTXJCCPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FN/c1-5(6)3-7(2)4-5/h3-4H2,1-2H3.
What are the key properties of 3-fluoro-1,3-dimethylazetidine?
3-fluoro-1,3-dimethylazetidine has a molecular weight of 103.14 g/mol, XLogP of 0.66, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1,3-dimethylazetidine is sourced from PubChem (CID 89296536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).