2-(2-methyl-4-propylphenyl)thiophene

C14H16S — CID 163647505

IUPAC2-(2-methyl-4-propylphenyl)thiophene
SMILESCCCc1ccc(-c2cccs2)c(C)c1
InChIInChI=1S/C14H16S/c1-3-5-12-7-8-13(11(2)10-12)14-6-4-9-15-14/h4,6-10H,3,5H2,1-2H3
InChIKeyIJMUFXRILDLILP-UHFFFAOYSA-N
MW216.35 g/mol
LogP4.68
Rot. Bonds3

About 2-(2-methyl-4-propylphenyl)thiophene

2-(2-methyl-4-propylphenyl)thiophene (PubChem CID 163647505) has the molecular formula C14H16S and a molecular weight of 216.35 g/mol. Its IUPAC name is 2-(2-methyl-4-propylphenyl)thiophene.

Molecular Properties

Compound Name2-(2-methyl-4-propylphenyl)thiophene
PubChem CID163647505
Molecular FormulaC14H16S
Molecular Weight216.35 g/mol
Exact Mass216.10
IUPAC Name2-(2-methyl-4-propylphenyl)thiophene
SMILESCCCc1ccc(-c2cccs2)c(C)c1
InChIInChI=1S/C14H16S/c1-3-5-12-7-8-13(11(2)10-12)14-6-4-9-15-14/h4,6-10H,3,5H2,1-2H3
InChIKeyIJMUFXRILDLILP-UHFFFAOYSA-N
XLogP4.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-propylphenyl)thiophene?
The IUPAC name of 2-(2-methyl-4-propylphenyl)thiophene (CID 163647505) is 2-(2-methyl-4-propylphenyl)thiophene.
What is the SMILES notation for 2-(2-methyl-4-propylphenyl)thiophene?
The canonical SMILES for 2-(2-methyl-4-propylphenyl)thiophene is CCCc1ccc(-c2cccs2)c(C)c1.
What is the InChIKey of 2-(2-methyl-4-propylphenyl)thiophene?
The InChIKey is IJMUFXRILDLILP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16S/c1-3-5-12-7-8-13(11(2)10-12)14-6-4-9-15-14/h4,6-10H,3,5H2,1-2H3.
What are the key properties of 2-(2-methyl-4-propylphenyl)thiophene?
2-(2-methyl-4-propylphenyl)thiophene has a molecular weight of 216.35 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-propylphenyl)thiophene is sourced from PubChem (CID 163647505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).