1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone

C10H10N2OS2 — CID 105091135

IUPAC1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone
SMILESCCc1nnsc1C(=O)Cc1ccsc1
InChIInChI=1S/C10H10N2OS2/c1-2-8-10(15-12-11-8)9(13)5-7-3-4-14-6-7/h3-4,6H,2,5H2,1H3
InChIKeyGJIQEGFPZYHTIJ-UHFFFAOYSA-N
MW238.34 g/mol
LogP2.59
Rot. Bonds4

About 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone

1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone (PubChem CID 105091135) has the molecular formula C10H10N2OS2 and a molecular weight of 238.34 g/mol. Its IUPAC name is 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone.

Molecular Properties

Compound Name1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone
PubChem CID105091135
Molecular FormulaC10H10N2OS2
Molecular Weight238.34 g/mol
Exact Mass238.02
IUPAC Name1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone
SMILESCCc1nnsc1C(=O)Cc1ccsc1
InChIInChI=1S/C10H10N2OS2/c1-2-8-10(15-12-11-8)9(13)5-7-3-4-14-6-7/h3-4,6H,2,5H2,1H3
InChIKeyGJIQEGFPZYHTIJ-UHFFFAOYSA-N
XLogP2.59
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.34
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-bromophenyl)-1-(4-ethylthiadiazol-5-yl)ethanone
CID 105079140
1-(4-ethylthiadiazol-5-yl)-2-pyridin-2-ylethanone
CID 105108103
4-ethylthiadiazole-5-carboxamide
CID 45084470
1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanamine
CID 105137431
(4-propylthiadiazol-5-yl)-thiophen-3-ylmethanone
CID 105104983
1-(4-ethylthiadiazol-5-yl)-2-(2-propan-2-yl-1,2,4-triazol-3-yl)ethanone
CID 105110386
N'-benzoyl-4-ethylthiadiazole-5-carbohydrazide
CID 46522979
(3-bromothiophen-2-yl)-(4-ethylthiadiazol-5-yl)methanone
CID 105122356
2-(3-bromothiophen-2-yl)-1-(4-propylthiadiazol-5-yl)ethanone
CID 105092769
2-(1-cyclohexylpyrazol-3-yl)-1-(4-ethylthiadiazol-5-yl)ethanone
CID 105104785
1-(1-ethylimidazol-2-yl)-2-thiophen-3-ylethanone
CID 105101257
2-cyclopentyl-1-(4-ethylthiadiazol-5-yl)ethanone
CID 105092243

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone?
The IUPAC name of 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone (CID 105091135) is 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone.
What is the SMILES notation for 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone?
The canonical SMILES for 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone is CCc1nnsc1C(=O)Cc1ccsc1.
What is the InChIKey of 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone?
The InChIKey is GJIQEGFPZYHTIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS2/c1-2-8-10(15-12-11-8)9(13)5-7-3-4-14-6-7/h3-4,6H,2,5H2,1H3.
What are the key properties of 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone?
1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone has a molecular weight of 238.34 g/mol, XLogP of 2.59, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylthiadiazol-5-yl)-2-thiophen-3-ylethanone is sourced from PubChem (CID 105091135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).