2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran

C12H14OS — CID 163232999

IUPAC2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran
SMILESCc1csc(-c2cc(C(C)C)co2)c1
InChIInChI=1S/C12H14OS/c1-8(2)10-5-11(13-6-10)12-4-9(3)7-14-12/h4-8H,1-3H3
InChIKeyNZCLNUSTEMRXEG-UHFFFAOYSA-N
MW206.31 g/mol
LogP4.44
Rot. Bonds2

About 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran

2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran (PubChem CID 163232999) has the molecular formula C12H14OS and a molecular weight of 206.31 g/mol. Its IUPAC name is 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran.

Molecular Properties

Compound Name2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran
PubChem CID163232999
Molecular FormulaC12H14OS
Molecular Weight206.31 g/mol
Exact Mass206.08
IUPAC Name2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran
SMILESCc1csc(-c2cc(C(C)C)co2)c1
InChIInChI=1S/C12H14OS/c1-8(2)10-5-11(13-6-10)12-4-9(3)7-14-12/h4-8H,1-3H3
InChIKeyNZCLNUSTEMRXEG-UHFFFAOYSA-N
XLogP4.44
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran with MolForge

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

Launch Full Analysis

Related Compounds

4-propan-2-yl-2-(4-propan-2-ylthiophen-2-yl)furan;2-propan-2-yl-5-(5-propan-2-ylthiophen-2-yl)thiophene
CID 163233159
2-(4-methylthiophen-2-yl)-5-[5-[5-[5-(4-methylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]thiophen-2-yl]thiophene
CID 11752772
2,5-bis(4-methylthiophen-2-yl)thiophene
CID 11097816
4-methyl-2-(3-methylbut-1-en-2-yl)thiophene
CID 126628471
4-propan-2-yl-2-(2,2,4-trimethylpentan-3-yl)furan
CID 20795799
(1S)-1-(4-propan-2-ylfuran-2-yl)propan-1-amine
CID 124653595
2,4-di(propan-2-yl)furan;2,5-di(propan-2-yl)furan;2,4-di(propan-2-yl)thiophene;2,5-di(propan-2-yl)thiophene
CID 158687824
2-ethenyl-4-propan-2-ylfuran
CID 154202119
2-(iodomethyl)-4-propan-2-ylfuran
CID 143077100
1-(5-methylfuran-3-yl)ethanol
CID 112692743
2-chloro-5-(4-methylthiophen-2-yl)-1,3,4-oxadiazole
CID 130778751
2,4-bis(4-methylthiophen-2-yl)pentan-3-one
CID 67705817

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran?
The IUPAC name of 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran (CID 163232999) is 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran.
What is the SMILES notation for 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran?
The canonical SMILES for 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran is Cc1csc(-c2cc(C(C)C)co2)c1.
What is the InChIKey of 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran?
The InChIKey is NZCLNUSTEMRXEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14OS/c1-8(2)10-5-11(13-6-10)12-4-9(3)7-14-12/h4-8H,1-3H3.
What are the key properties of 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran?
2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran has a molecular weight of 206.31 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylthiophen-2-yl)-4-propan-2-ylfuran is sourced from PubChem (CID 163232999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).