3-(4-fluorothiophen-3-yl)azetidine

C7H8FNS — CID 168982631

IUPAC3-(4-fluorothiophen-3-yl)azetidine
SMILESFc1cscc1C1CNC1
InChIInChI=1S/C7H8FNS/c8-7-4-10-3-6(7)5-1-9-2-5/h3-5,9H,1-2H2
InChIKeyOIZHLPGFLRGWDL-UHFFFAOYSA-N
MW157.21 g/mol
LogP1.57
Rot. Bonds1

About 3-(4-fluorothiophen-3-yl)azetidine

3-(4-fluorothiophen-3-yl)azetidine (PubChem CID 168982631) has the molecular formula C7H8FNS and a molecular weight of 157.21 g/mol. Its IUPAC name is 3-(4-fluorothiophen-3-yl)azetidine.

Molecular Properties

Compound Name3-(4-fluorothiophen-3-yl)azetidine
PubChem CID168982631
Molecular FormulaC7H8FNS
Molecular Weight157.21 g/mol
Exact Mass157.04
IUPAC Name3-(4-fluorothiophen-3-yl)azetidine
SMILESFc1cscc1C1CNC1
InChIInChI=1S/C7H8FNS/c8-7-4-10-3-6(7)5-1-9-2-5/h3-5,9H,1-2H2
InChIKeyOIZHLPGFLRGWDL-UHFFFAOYSA-N
XLogP1.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorothiophen-3-yl)azetidine?
The IUPAC name of 3-(4-fluorothiophen-3-yl)azetidine (CID 168982631) is 3-(4-fluorothiophen-3-yl)azetidine.
What is the SMILES notation for 3-(4-fluorothiophen-3-yl)azetidine?
The canonical SMILES for 3-(4-fluorothiophen-3-yl)azetidine is Fc1cscc1C1CNC1.
What is the InChIKey of 3-(4-fluorothiophen-3-yl)azetidine?
The InChIKey is OIZHLPGFLRGWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FNS/c8-7-4-10-3-6(7)5-1-9-2-5/h3-5,9H,1-2H2.
What are the key properties of 3-(4-fluorothiophen-3-yl)azetidine?
3-(4-fluorothiophen-3-yl)azetidine has a molecular weight of 157.21 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorothiophen-3-yl)azetidine is sourced from PubChem (CID 168982631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).