3-(2-fluoroethoxy)-3-methylazetidine

C6H12FNO — CID 83067666

IUPAC3-(2-fluoroethoxy)-3-methylazetidine
SMILESCC1(OCCF)CNC1
InChIInChI=1S/C6H12FNO/c1-6(4-8-5-6)9-3-2-7/h8H,2-5H2,1H3
InChIKeyYHTYKFKEGRZEEE-UHFFFAOYSA-N
MW133.17 g/mol
LogP0.33
Rot. Bonds3

About 3-(2-fluoroethoxy)-3-methylazetidine

3-(2-fluoroethoxy)-3-methylazetidine (PubChem CID 83067666) has the molecular formula C6H12FNO and a molecular weight of 133.17 g/mol. Its IUPAC name is 3-(2-fluoroethoxy)-3-methylazetidine.

Molecular Properties

Compound Name3-(2-fluoroethoxy)-3-methylazetidine
PubChem CID83067666
Molecular FormulaC6H12FNO
Molecular Weight133.17 g/mol
Exact Mass133.09
IUPAC Name3-(2-fluoroethoxy)-3-methylazetidine
SMILESCC1(OCCF)CNC1
InChIInChI=1S/C6H12FNO/c1-6(4-8-5-6)9-3-2-7/h8H,2-5H2,1H3
InChIKeyYHTYKFKEGRZEEE-UHFFFAOYSA-N
XLogP0.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.17
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethoxy)-3-methylazetidine?
The IUPAC name of 3-(2-fluoroethoxy)-3-methylazetidine (CID 83067666) is 3-(2-fluoroethoxy)-3-methylazetidine.
What is the SMILES notation for 3-(2-fluoroethoxy)-3-methylazetidine?
The canonical SMILES for 3-(2-fluoroethoxy)-3-methylazetidine is CC1(OCCF)CNC1.
What is the InChIKey of 3-(2-fluoroethoxy)-3-methylazetidine?
The InChIKey is YHTYKFKEGRZEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FNO/c1-6(4-8-5-6)9-3-2-7/h8H,2-5H2,1H3.
What are the key properties of 3-(2-fluoroethoxy)-3-methylazetidine?
3-(2-fluoroethoxy)-3-methylazetidine has a molecular weight of 133.17 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethoxy)-3-methylazetidine is sourced from PubChem (CID 83067666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).