3-methyl-2-(2-methylpropyl)thiophene

C9H14S — CID 10241021

IUPAC3-methyl-2-(2-methylpropyl)thiophene
SMILESCc1ccsc1CC(C)C
InChIInChI=1S/C9H14S/c1-7(2)6-9-8(3)4-5-10-9/h4-5,7H,6H2,1-3H3
InChIKeyRZUXCXVPQXRSCO-UHFFFAOYSA-N
MW154.28 g/mol
LogP3.26
Rot. Bonds2

About 3-methyl-2-(2-methylpropyl)thiophene

3-methyl-2-(2-methylpropyl)thiophene (PubChem CID 10241021) has the molecular formula C9H14S and a molecular weight of 154.28 g/mol. Its IUPAC name is 3-methyl-2-(2-methylpropyl)thiophene.

Molecular Properties

Compound Name3-methyl-2-(2-methylpropyl)thiophene
PubChem CID10241021
Molecular FormulaC9H14S
Molecular Weight154.28 g/mol
Exact Mass154.08
IUPAC Name3-methyl-2-(2-methylpropyl)thiophene
SMILESCc1ccsc1CC(C)C
InChIInChI=1S/C9H14S/c1-7(2)6-9-8(3)4-5-10-9/h4-5,7H,6H2,1-3H3
InChIKeyRZUXCXVPQXRSCO-UHFFFAOYSA-N
XLogP3.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.28
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(2-methylpropyl)thiophene?
The IUPAC name of 3-methyl-2-(2-methylpropyl)thiophene (CID 10241021) is 3-methyl-2-(2-methylpropyl)thiophene.
What is the SMILES notation for 3-methyl-2-(2-methylpropyl)thiophene?
The canonical SMILES for 3-methyl-2-(2-methylpropyl)thiophene is Cc1ccsc1CC(C)C.
What is the InChIKey of 3-methyl-2-(2-methylpropyl)thiophene?
The InChIKey is RZUXCXVPQXRSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14S/c1-7(2)6-9-8(3)4-5-10-9/h4-5,7H,6H2,1-3H3.
What are the key properties of 3-methyl-2-(2-methylpropyl)thiophene?
3-methyl-2-(2-methylpropyl)thiophene has a molecular weight of 154.28 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(2-methylpropyl)thiophene is sourced from PubChem (CID 10241021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).