2-methyl-5-phenoxythiophene

C11H10OS — CID 18738987

IUPAC2-methyl-5-phenoxythiophene
SMILESCc1ccc(Oc2ccccc2)s1
InChIInChI=1S/C11H10OS/c1-9-7-8-11(13-9)12-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeySDDDVVWWCRVEDK-UHFFFAOYSA-N
MW190.27 g/mol
LogP3.85
Rot. Bonds2

About 2-methyl-5-phenoxythiophene

2-methyl-5-phenoxythiophene (PubChem CID 18738987) has the molecular formula C11H10OS and a molecular weight of 190.27 g/mol. Its IUPAC name is 2-methyl-5-phenoxythiophene.

Molecular Properties

Compound Name2-methyl-5-phenoxythiophene
PubChem CID18738987
Molecular FormulaC11H10OS
Molecular Weight190.27 g/mol
Exact Mass190.05
IUPAC Name2-methyl-5-phenoxythiophene
SMILESCc1ccc(Oc2ccccc2)s1
InChIInChI=1S/C11H10OS/c1-9-7-8-11(13-9)12-10-5-3-2-4-6-10/h2-8H,1H3
InChIKeySDDDVVWWCRVEDK-UHFFFAOYSA-N
XLogP3.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-5-phenoxythiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-phenoxythiophene?
The IUPAC name of 2-methyl-5-phenoxythiophene (CID 18738987) is 2-methyl-5-phenoxythiophene.
What is the SMILES notation for 2-methyl-5-phenoxythiophene?
The canonical SMILES for 2-methyl-5-phenoxythiophene is Cc1ccc(Oc2ccccc2)s1.
What is the InChIKey of 2-methyl-5-phenoxythiophene?
The InChIKey is SDDDVVWWCRVEDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10OS/c1-9-7-8-11(13-9)12-10-5-3-2-4-6-10/h2-8H,1H3.
What are the key properties of 2-methyl-5-phenoxythiophene?
2-methyl-5-phenoxythiophene has a molecular weight of 190.27 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-phenoxythiophene is sourced from PubChem (CID 18738987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).