3-(fluoromethyl)-1-(2-methoxyethyl)azetidine

C7H14FNO — CID 123322216

IUPAC3-(fluoromethyl)-1-(2-methoxyethyl)azetidine
SMILESCOCCN1CC(CF)C1
InChIInChI=1S/C7H14FNO/c1-10-3-2-9-5-7(4-8)6-9/h7H,2-6H2,1H3
InChIKeyZYCCZLBVWQGGKV-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.53
Rot. Bonds4

About 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine

3-(fluoromethyl)-1-(2-methoxyethyl)azetidine (PubChem CID 123322216) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine.

Molecular Properties

Compound Name3-(fluoromethyl)-1-(2-methoxyethyl)azetidine
PubChem CID123322216
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name3-(fluoromethyl)-1-(2-methoxyethyl)azetidine
SMILESCOCCN1CC(CF)C1
InChIInChI=1S/C7H14FNO/c1-10-3-2-9-5-7(4-8)6-9/h7H,2-6H2,1H3
InChIKeyZYCCZLBVWQGGKV-UHFFFAOYSA-N
XLogP0.53
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine?
The IUPAC name of 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine (CID 123322216) is 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine.
What is the SMILES notation for 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine?
The canonical SMILES for 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine is COCCN1CC(CF)C1.
What is the InChIKey of 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine?
The InChIKey is ZYCCZLBVWQGGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-10-3-2-9-5-7(4-8)6-9/h7H,2-6H2,1H3.
What are the key properties of 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine?
3-(fluoromethyl)-1-(2-methoxyethyl)azetidine has a molecular weight of 147.19 g/mol, XLogP of 0.53, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethyl)-1-(2-methoxyethyl)azetidine is sourced from PubChem (CID 123322216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).