4-ethylthiadiazole-5-carboxamide

C5H7N3OS — CID 45084470

IUPAC4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(N)=O
InChIInChI=1S/C5H7N3OS/c1-2-3-4(5(6)9)10-8-7-3/h2H2,1H3,(H2,6,9)
InChIKeyYQSBEYPYNVGYLN-UHFFFAOYSA-N
MW157.20 g/mol
LogP0.20
Rot. Bonds2

About 4-ethylthiadiazole-5-carboxamide

4-ethylthiadiazole-5-carboxamide (PubChem CID 45084470) has the molecular formula C5H7N3OS and a molecular weight of 157.20 g/mol. Its IUPAC name is 4-ethylthiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethylthiadiazole-5-carboxamide
PubChem CID45084470
Molecular FormulaC5H7N3OS
Molecular Weight157.20 g/mol
Exact Mass157.03
IUPAC Name4-ethylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(N)=O
InChIInChI=1S/C5H7N3OS/c1-2-3-4(5(6)9)10-8-7-3/h2H2,1H3,(H2,6,9)
InChIKeyYQSBEYPYNVGYLN-UHFFFAOYSA-N
XLogP0.20
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethylthiadiazole-5-carbonyl chloride
CID 18524959
4-ethyl-N-[2-(methylamino)ethyl]thiadiazole-5-carboxamide
CID 65210280
tert-butylazanium;4-ethylthiadiazole-5-carboxylate
CID 18667662
4-ethyl-N-[3-(methylamino)propyl]thiadiazole-5-carboxamide
CID 65210223
N-[(2S)-1-aminopropan-2-yl]-4-ethylthiadiazole-5-carboxamide;hydrochloride
CID 120505502
1-(4-ethylthiadiazol-5-yl)-4,4,4-trifluorobutan-1-one
CID 105106889
N-(1-amino-1-sulfanylidenepropan-2-yl)-4-ethyl-N-methylthiadiazole-5-carboxamide
CID 65205074
2-cyclopentyl-1-(4-ethylthiadiazol-5-yl)ethanone
CID 105092243
N-[1-(aminomethyl)cyclopentyl]-4-ethylthiadiazole-5-carboxamide
CID 65210136
4-ethyl-N-(2-hydroxy-2-methylpropyl)-N-methylthiadiazole-5-carboxamide
CID 79382432
N-(1-chloro-2-methylpropan-2-yl)-4-ethylthiadiazole-5-carboxamide
CID 114294992
N-cyclopentyl-4-ethylthiadiazole-5-carboxamide
CID 51204913

Frequently Asked Questions

What is the IUPAC name of 4-ethylthiadiazole-5-carboxamide?
The IUPAC name of 4-ethylthiadiazole-5-carboxamide (CID 45084470) is 4-ethylthiadiazole-5-carboxamide.
What is the SMILES notation for 4-ethylthiadiazole-5-carboxamide?
The canonical SMILES for 4-ethylthiadiazole-5-carboxamide is CCc1nnsc1C(N)=O.
What is the InChIKey of 4-ethylthiadiazole-5-carboxamide?
The InChIKey is YQSBEYPYNVGYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3OS/c1-2-3-4(5(6)9)10-8-7-3/h2H2,1H3,(H2,6,9).
What are the key properties of 4-ethylthiadiazole-5-carboxamide?
4-ethylthiadiazole-5-carboxamide has a molecular weight of 157.20 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylthiadiazole-5-carboxamide is sourced from PubChem (CID 45084470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).