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

3-fluoro-1,3-dimethylazetidine;3-fluoro-3-methylazetidine;3-fluoro-3-methyloxetane
CID 162174730
3,3-difluoro-1-methylazetidine;ethane;methane
CID 153377550
ethane;(1S,5R)-1,3,5-trimethyl-3-azabicyclo[3.1.0]hexane
CID 168910371
ethane;1,3,5-trimethyl-3-azabicyclo[3.1.1]heptane
CID 177137532
2,2-difluoro-5-methyl-5-azaspiro[2.3]hexane
CID 129180153
CID 58944995
CID 58944995
ethane;3-fluoro-3-methyl-1-propylazetidine
CID 153356034
3a-fluoro-5,6a-dimethyl-2,3,4,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 176992944
1-fluoro-1-methylcyclopropane
CID 18684623
ethane;1-ethyl-3-fluoro-3-methylazetidine
CID 178155660
1,3,5,6-tetramethyl-3-azabicyclo[3.1.0]hexane
CID 167503016
1-hydroxy-2,2,4,6,6-pentamethylpiperazine
CID 126542485

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).