(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone

C12H12O2S — CID 81155979

IUPAC(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone
SMILESCc1ccc(C(=O)c2sc(C)cc2C)o1
InChIInChI=1S/C12H12O2S/c1-7-6-9(3)15-12(7)11(13)10-5-4-8(2)14-10/h4-6H,1-3H3
InChIKeyYSIHOBDYNCNBJB-UHFFFAOYSA-N
MW220.29 g/mol
LogP3.50
Rot. Bonds2

About (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone

(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone (PubChem CID 81155979) has the molecular formula C12H12O2S and a molecular weight of 220.29 g/mol. Its IUPAC name is (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone.

Molecular Properties

Compound Name(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone
PubChem CID81155979
Molecular FormulaC12H12O2S
Molecular Weight220.29 g/mol
Exact Mass220.06
IUPAC Name(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone
SMILESCc1ccc(C(=O)c2sc(C)cc2C)o1
InChIInChI=1S/C12H12O2S/c1-7-6-9(3)15-12(7)11(13)10-5-4-8(2)14-10/h4-6H,1-3H3
InChIKeyYSIHOBDYNCNBJB-UHFFFAOYSA-N
XLogP3.50
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone 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

(5-chloro-4-methylthiophen-2-yl)-(5-methylfuran-2-yl)methanone
CID 102762834
(3-ethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone
CID 79985780
(2,5-dichlorothiophen-3-yl)-(5-methylfuran-2-yl)methanone
CID 43463797
3,5-dimethylthiophene-2-carboxylic acid
CID 819558
(2,5-dichlorophenyl)-(3,5-dimethylthiophen-2-yl)methanone
CID 81157333
(3-bromo-5-methylthiophen-2-yl)-(5-nitrofuran-2-yl)methanone
CID 65279432
(2-fluoro-4,6-dimethylphenyl)-(5-methylfuran-2-yl)methanone
CID 106883290
(3,5-dimethylthiophen-2-yl)-naphthalen-2-ylmethanone
CID 81156369
2-(4-chlorophenyl)-1-(3,5-dimethylthiophen-2-yl)ethanone
CID 81157445
(3,4-dichlorophenyl)-(5-methylfuran-2-yl)methanone
CID 43463771
(4,5-dibromothiophen-2-yl)-(3,5-dimethylthiophen-2-yl)methanone
CID 81155980
(3-chloro-4-fluorophenyl)-(3,5-dimethylthiophen-2-yl)methanone
CID 82875204

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone?
The IUPAC name of (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone (CID 81155979) is (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone.
What is the SMILES notation for (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone?
The canonical SMILES for (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone is Cc1ccc(C(=O)c2sc(C)cc2C)o1.
What is the InChIKey of (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone?
The InChIKey is YSIHOBDYNCNBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2S/c1-7-6-9(3)15-12(7)11(13)10-5-4-8(2)14-10/h4-6H,1-3H3.
What are the key properties of (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone?
(3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone has a molecular weight of 220.29 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylthiophen-2-yl)-(5-methylfuran-2-yl)methanone is sourced from PubChem (CID 81155979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).