5-methylidene-2H-thiophene

C5H6S — CID 59165079

IUPAC5-methylidene-2H-thiophene
SMILESC=C1C=CCS1
InChIInChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-3H,1,4H2
InChIKeyWTCSOMGIDOTNBG-UHFFFAOYSA-N
MW98.17 g/mol
LogP1.80
Rot. Bonds

About 5-methylidene-2H-thiophene

5-methylidene-2H-thiophene (PubChem CID 59165079) has the molecular formula C5H6S and a molecular weight of 98.17 g/mol. Its IUPAC name is 5-methylidene-2H-thiophene.

Molecular Properties

Compound Name5-methylidene-2H-thiophene
PubChem CID59165079
Molecular FormulaC5H6S
Molecular Weight98.17 g/mol
Exact Mass98.02
IUPAC Name5-methylidene-2H-thiophene
SMILESC=C1C=CCS1
InChIInChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-3H,1,4H2
InChIKeyWTCSOMGIDOTNBG-UHFFFAOYSA-N
XLogP1.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.17
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methylidene-2H-thiophene?
The IUPAC name of 5-methylidene-2H-thiophene (CID 59165079) is 5-methylidene-2H-thiophene.
What is the SMILES notation for 5-methylidene-2H-thiophene?
The canonical SMILES for 5-methylidene-2H-thiophene is C=C1C=CCS1.
What is the InChIKey of 5-methylidene-2H-thiophene?
The InChIKey is WTCSOMGIDOTNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-3H,1,4H2.
What are the key properties of 5-methylidene-2H-thiophene?
5-methylidene-2H-thiophene has a molecular weight of 98.17 g/mol, XLogP of 1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-2H-thiophene is sourced from PubChem (CID 59165079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).