3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan

C13H9FOS2 — CID 161280294

IUPAC3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan
SMILESC=C1OCC(c2ccc(F)s2)=C1c1cccs1
InChIInChI=1S/C13H9FOS2/c1-8-13(11-3-2-6-16-11)9(7-15-8)10-4-5-12(14)17-10/h2-6H,1,7H2
InChIKeySMDGZDJMBKISGE-UHFFFAOYSA-N
MW264.35 g/mol
LogP4.40
Rot. Bonds2

About 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan

3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan (PubChem CID 161280294) has the molecular formula C13H9FOS2 and a molecular weight of 264.35 g/mol. Its IUPAC name is 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan.

Molecular Properties

Compound Name3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan
PubChem CID161280294
Molecular FormulaC13H9FOS2
Molecular Weight264.35 g/mol
Exact Mass264.01
IUPAC Name3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan
SMILESC=C1OCC(c2ccc(F)s2)=C1c1cccs1
InChIInChI=1S/C13H9FOS2/c1-8-13(11-3-2-6-16-11)9(7-15-8)10-4-5-12(14)17-10/h2-6H,1,7H2
InChIKeySMDGZDJMBKISGE-UHFFFAOYSA-N
XLogP4.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan?
The IUPAC name of 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan (CID 161280294) is 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan.
What is the SMILES notation for 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan?
The canonical SMILES for 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan is C=C1OCC(c2ccc(F)s2)=C1c1cccs1.
What is the InChIKey of 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan?
The InChIKey is SMDGZDJMBKISGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FOS2/c1-8-13(11-3-2-6-16-11)9(7-15-8)10-4-5-12(14)17-10/h2-6H,1,7H2.
What are the key properties of 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan?
3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan has a molecular weight of 264.35 g/mol, XLogP of 4.40, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-fluorothiophen-2-yl)-5-methylidene-4-thiophen-2-yl-2H-furan is sourced from PubChem (CID 161280294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).