1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene

C9H12S — CID 129040041

IUPAC1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene
SMILESCc1sc(C)c2c1CCC2
InChIInChI=1S/C9H12S/c1-6-8-4-3-5-9(8)7(2)10-6/h3-5H2,1-2H3
InChIKeyWPOOKHILFLDTGL-UHFFFAOYSA-N
MW152.26 g/mol
LogP2.85
Rot. Bonds

About 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene

1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene (PubChem CID 129040041) has the molecular formula C9H12S and a molecular weight of 152.26 g/mol. Its IUPAC name is 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene.

Molecular Properties

Compound Name1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene
PubChem CID129040041
Molecular FormulaC9H12S
Molecular Weight152.26 g/mol
Exact Mass152.07
IUPAC Name1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene
SMILESCc1sc(C)c2c1CCC2
InChIInChI=1S/C9H12S/c1-6-8-4-3-5-9(8)7(2)10-6/h3-5H2,1-2H3
InChIKeyWPOOKHILFLDTGL-UHFFFAOYSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.26
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene?
The IUPAC name of 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene (CID 129040041) is 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene.
What is the SMILES notation for 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene?
The canonical SMILES for 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene is Cc1sc(C)c2c1CCC2.
What is the InChIKey of 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene?
The InChIKey is WPOOKHILFLDTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12S/c1-6-8-4-3-5-9(8)7(2)10-6/h3-5H2,1-2H3.
What are the key properties of 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene?
1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene has a molecular weight of 152.26 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5,6-dihydro-4H-cyclopenta[c]thiophene is sourced from PubChem (CID 129040041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).