4,5-diethylthiadiazole

C6H10N2S — CID 90298396

IUPAC4,5-diethylthiadiazole
SMILESCCc1nnsc1CC
InChIInChI=1S/C6H10N2S/c1-3-5-6(4-2)9-8-7-5/h3-4H2,1-2H3
InChIKeyFUFMZGNDWSYRBA-UHFFFAOYSA-N
MW142.23 g/mol
LogP1.66
Rot. Bonds2

About 4,5-diethylthiadiazole

4,5-diethylthiadiazole (PubChem CID 90298396) has the molecular formula C6H10N2S and a molecular weight of 142.23 g/mol. Its IUPAC name is 4,5-diethylthiadiazole.

Molecular Properties

Compound Name4,5-diethylthiadiazole
PubChem CID90298396
Molecular FormulaC6H10N2S
Molecular Weight142.23 g/mol
Exact Mass142.06
IUPAC Name4,5-diethylthiadiazole
SMILESCCc1nnsc1CC
InChIInChI=1S/C6H10N2S/c1-3-5-6(4-2)9-8-7-5/h3-4H2,1-2H3
InChIKeyFUFMZGNDWSYRBA-UHFFFAOYSA-N
XLogP1.66
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.23
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-Bromoethyl)-4-methyl-1,2,3-thiadiazole
CID 12679020
4-Tert-butyl-5-methylthiadiazole
CID 12552709
4-Tert-butyl-5-propan-2-ylthiadiazole
CID 12552710
4,5-Ditert-butylthiadiazole
CID 57792113
4-Ethyl-5-(fluoromethyl)thiadiazole
CID 141237802
5-Ethyl-4-(fluoromethyl)thiadiazole
CID 141237842
5-Ethyl-4-methylthiadiazole
CID 12679017
4-Methyl-5-propylthiadiazole
CID 12913685
4,5,6,7,8,9-Hexahydrocycloocta[d]thiadiazole
CID 12206276
4,5,6,7,8,9,10,11,12,13-Decahydrocyclododeca[d]thiadiazole
CID 12565898
4-Ethyl-5-methylthiadiazole
CID 12679016
4-Methyl-5-pentyl-1,2,3-thiadiazole
CID 13427196

Frequently Asked Questions

What is the IUPAC name of 4,5-diethylthiadiazole?
The IUPAC name of 4,5-diethylthiadiazole (CID 90298396) is 4,5-diethylthiadiazole.
What is the SMILES notation for 4,5-diethylthiadiazole?
The canonical SMILES for 4,5-diethylthiadiazole is CCc1nnsc1CC.
What is the InChIKey of 4,5-diethylthiadiazole?
The InChIKey is FUFMZGNDWSYRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S/c1-3-5-6(4-2)9-8-7-5/h3-4H2,1-2H3.
What are the key properties of 4,5-diethylthiadiazole?
4,5-diethylthiadiazole has a molecular weight of 142.23 g/mol, XLogP of 1.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diethylthiadiazole is sourced from PubChem (CID 90298396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).