1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone

C11H10O2S — CID 61056697

IUPAC1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone
SMILESCc1ccc(C(=O)Cc2cccs2)o1
InChIInChI=1S/C11H10O2S/c1-8-4-5-11(13-8)10(12)7-9-3-2-6-14-9/h2-6H,7H2,1H3
InChIKeyUEQFTLRYQYGSHC-UHFFFAOYSA-N
MW206.27 g/mol
LogP3.07
Rot. Bonds3

About 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone

1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone (PubChem CID 61056697) has the molecular formula C11H10O2S and a molecular weight of 206.27 g/mol. Its IUPAC name is 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone.

Molecular Properties

Compound Name1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone
PubChem CID61056697
Molecular FormulaC11H10O2S
Molecular Weight206.27 g/mol
Exact Mass206.04
IUPAC Name1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone
SMILESCc1ccc(C(=O)Cc2cccs2)o1
InChIInChI=1S/C11H10O2S/c1-8-4-5-11(13-8)10(12)7-9-3-2-6-14-9/h2-6H,7H2,1H3
InChIKeyUEQFTLRYQYGSHC-UHFFFAOYSA-N
XLogP3.07
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-ethylfuran-2-yl)-2-thiophen-2-ylethanone
CID 79095620
1-(5-methylfuran-2-yl)-2-phenylethanone
CID 4610358
2-(4-ethylphenyl)-1-(5-methylfuran-2-yl)ethanone
CID 114963390
N-[1-(5-methylfuran-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 47007711
N-[(1R)-1-(5-methylfuran-2-yl)ethyl]-2-thiophen-2-ylacetamide
CID 94182945
1-(4-methylfuran-3-yl)-2-thiophen-2-ylethanone
CID 131207475
1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanone
CID 61054883
1-(4-methyl-2-pyridinyl)-2-thiophen-2-ylethanone
CID 63840069
2-(furan-3-yl)-1-(5-methylfuran-2-yl)ethanone
CID 115795779
1-(6-methyl-2-pyridinyl)-2-thiophen-2-ylethanone
CID 63554522
4-(5-methylfuran-2-carbonyl)-N-(thiophen-2-ylmethyl)piperazine-1-carboxamide
CID 166181138
[1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 5-methylfuran-2-carboxylate
CID 47011570

Frequently Asked Questions

What is the IUPAC name of 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone?
The IUPAC name of 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone (CID 61056697) is 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone.
What is the SMILES notation for 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone?
The canonical SMILES for 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone is Cc1ccc(C(=O)Cc2cccs2)o1.
What is the InChIKey of 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone?
The InChIKey is UEQFTLRYQYGSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10O2S/c1-8-4-5-11(13-8)10(12)7-9-3-2-6-14-9/h2-6H,7H2,1H3.
What are the key properties of 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone?
1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone has a molecular weight of 206.27 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylfuran-2-yl)-2-thiophen-2-ylethanone is sourced from PubChem (CID 61056697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).