(2-methylthiophen-3-yl)-thiophen-2-ylmethanone

C10H8OS2 — CID 102830577

IUPAC(2-methylthiophen-3-yl)-thiophen-2-ylmethanone
SMILESCc1sccc1C(=O)c1cccs1
InChIInChI=1S/C10H8OS2/c1-7-8(4-6-12-7)10(11)9-3-2-5-13-9/h2-6H,1H3
InChIKeyWVIGVNBFFGZGST-UHFFFAOYSA-N
MW208.31 g/mol
LogP3.35
Rot. Bonds2

About (2-methylthiophen-3-yl)-thiophen-2-ylmethanone

(2-methylthiophen-3-yl)-thiophen-2-ylmethanone (PubChem CID 102830577) has the molecular formula C10H8OS2 and a molecular weight of 208.31 g/mol. Its IUPAC name is (2-methylthiophen-3-yl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(2-methylthiophen-3-yl)-thiophen-2-ylmethanone
PubChem CID102830577
Molecular FormulaC10H8OS2
Molecular Weight208.31 g/mol
Exact Mass208.00
IUPAC Name(2-methylthiophen-3-yl)-thiophen-2-ylmethanone
SMILESCc1sccc1C(=O)c1cccs1
InChIInChI=1S/C10H8OS2/c1-7-8(4-6-12-7)10(11)9-3-2-5-13-9/h2-6H,1H3
InChIKeyWVIGVNBFFGZGST-UHFFFAOYSA-N
XLogP3.35
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

bis(2-methylthiophen-3-yl)methanone
CID 101441488
dithiophen-2-ylmethanone;2-thiophen-2-ylthiophene
CID 161486915
furan-2-yl-(2-methylthiophen-3-yl)methanone
CID 102830703
(2-chlorophenyl)-(2-methylthiophen-3-yl)methanone
CID 102830683
(2-methylthiophen-3-yl)-pyrimidin-2-ylmethanone
CID 102830634
[3-(thiophene-2-carbonyl)naphthalen-2-yl]-thiophen-2-ylmethanone
CID 5082064
(2,3-dimethylphenyl)-(2-methylthiophen-3-yl)methanone
CID 102839866
(2-hydroxy-3,5-dimethylphenyl)-thiophen-2-ylmethanone
CID 13404184
(4-methoxy-2,3-dimethylphenyl)-thiophen-2-ylmethanone
CID 57091683
N-[2-(thiophene-2-carbonyl)phenyl]acetamide
CID 18987253
cyclohexen-1-yl-(2-methylthiophen-3-yl)methanone
CID 103449971
(4-hydroxy-1-benzothiophen-5-yl)-thiophen-2-ylmethanone
CID 139795818

Frequently Asked Questions

What is the IUPAC name of (2-methylthiophen-3-yl)-thiophen-2-ylmethanone?
The IUPAC name of (2-methylthiophen-3-yl)-thiophen-2-ylmethanone (CID 102830577) is (2-methylthiophen-3-yl)-thiophen-2-ylmethanone.
What is the SMILES notation for (2-methylthiophen-3-yl)-thiophen-2-ylmethanone?
The canonical SMILES for (2-methylthiophen-3-yl)-thiophen-2-ylmethanone is Cc1sccc1C(=O)c1cccs1.
What is the InChIKey of (2-methylthiophen-3-yl)-thiophen-2-ylmethanone?
The InChIKey is WVIGVNBFFGZGST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8OS2/c1-7-8(4-6-12-7)10(11)9-3-2-5-13-9/h2-6H,1H3.
What are the key properties of (2-methylthiophen-3-yl)-thiophen-2-ylmethanone?
(2-methylthiophen-3-yl)-thiophen-2-ylmethanone has a molecular weight of 208.31 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylthiophen-3-yl)-thiophen-2-ylmethanone is sourced from PubChem (CID 102830577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).