(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone

C10H8O2S2 — CID 114975247

IUPAC(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone
SMILESCOc1csc(C(=O)c2ccsc2)c1
InChIInChI=1S/C10H8O2S2/c1-12-8-4-9(14-6-8)10(11)7-2-3-13-5-7/h2-6H,1H3
InChIKeyCDQRJKVMTGIUQR-UHFFFAOYSA-N
MW224.31 g/mol
LogP3.05
Rot. Bonds3

About (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone

(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone (PubChem CID 114975247) has the molecular formula C10H8O2S2 and a molecular weight of 224.31 g/mol. Its IUPAC name is (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone.

Molecular Properties

Compound Name(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone
PubChem CID114975247
Molecular FormulaC10H8O2S2
Molecular Weight224.31 g/mol
Exact Mass224.00
IUPAC Name(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone
SMILESCOc1csc(C(=O)c2ccsc2)c1
InChIInChI=1S/C10H8O2S2/c1-12-8-4-9(14-6-8)10(11)7-2-3-13-5-7/h2-6H,1H3
InChIKeyCDQRJKVMTGIUQR-UHFFFAOYSA-N
XLogP3.05
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4-methoxythiophen-2-yl)-(4-methylphenyl)methanone
CID 81127341
(3,5-dimethylphenyl)-(4-methoxythiophen-2-yl)methanone
CID 114963052
(3-bromothiophen-2-yl)-(4-methoxythiophen-2-yl)methanone
CID 81127058
(3-fluoro-5-methylphenyl)-(4-methoxythiophen-2-yl)methanone
CID 115787659
(3-bromo-4-fluorophenyl)-(4-methoxythiophen-2-yl)methanone
CID 81127475
(2-chloro-4-methoxyphenyl)-thiophen-3-ylmethanone
CID 43561635
3,5-dimethoxy-N-[[5-(thiophene-3-carbonyl)thiophen-2-yl]methyl]benzamide
CID 90612558
(4-methoxythiophen-2-yl)-(1,3-thiazol-4-yl)methanone
CID 131204212
(4-methoxythiophen-2-yl)-(2-methylquinolin-6-yl)methanone
CID 115790453
(4-methoxythiophen-2-yl)-(2,3,5,6-tetramethylphenyl)methanone
CID 81127335
(3,4-dibromothiophen-2-yl)-(4-methoxythiophen-2-yl)methanone
CID 81126729
(2,5-dimethylphenyl)-(4-methoxythiophen-2-yl)methanone
CID 81127133

Frequently Asked Questions

What is the IUPAC name of (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone?
The IUPAC name of (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone (CID 114975247) is (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone.
What is the SMILES notation for (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone?
The canonical SMILES for (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone is COc1csc(C(=O)c2ccsc2)c1.
What is the InChIKey of (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone?
The InChIKey is CDQRJKVMTGIUQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8O2S2/c1-12-8-4-9(14-6-8)10(11)7-2-3-13-5-7/h2-6H,1H3.
What are the key properties of (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone?
(4-methoxythiophen-2-yl)-thiophen-3-ylmethanone has a molecular weight of 224.31 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxythiophen-2-yl)-thiophen-3-ylmethanone is sourced from PubChem (CID 114975247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).