5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride

C4H8ClN3S — CID 11971454

IUPAC5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride
SMILESCCc1nnc(N)s1.Cl
InChIInChI=1S/C4H7N3S.ClH/c1-2-3-6-7-4(5)8-3;/h2H2,1H3,(H2,5,7);1H
InChIKeyCTMYXGFTKJIYQI-UHFFFAOYSA-N
MW165.65 g/mol
LogP1.10
Rot. Bonds1

About 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride

5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride (PubChem CID 11971454) has the molecular formula C4H8ClN3S and a molecular weight of 165.65 g/mol. Its IUPAC name is 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride
PubChem CID11971454
Molecular FormulaC4H8ClN3S
Molecular Weight165.65 g/mol
Exact Mass165.01
IUPAC Name5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride
SMILESCCc1nnc(N)s1.Cl
InChIInChI=1S/C4H7N3S.ClH/c1-2-3-6-7-4(5)8-3;/h2H2,1H3,(H2,5,7);1H
InChIKeyCTMYXGFTKJIYQI-UHFFFAOYSA-N
XLogP1.10
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.65
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-5-ethyl-1,3,4-thiadiazole
CID 26444
1,3,4-Thiadiazole, 2-amino-5-methyl-
CID 66949
Buthidazolamine
CID 170170
5-Pentyl-1,3,4-thiadiazol-2-amine
CID 1622360
5-Propyl-1,3,4-thiadiazol-2-amine
CID 575394
1,3,4-Thiadiazole, 2-amino-5-methyl-, hydrochloride
CID 3044825
5-(2-Chloroethyl)-1,3,4-thiadiazol-2-amine
CID 15031707
5-Hexyl-1,3,4-thiadiazol-2-amine
CID 1895039
5-Isopropyl-1,3,4-thiadiazol-2-amine
CID 147151
5-(2-Methylpropyl)-1,3,4-thiadiazol-2-amine
CID 234308
5-(2-Methoxyethyl)-1,3,4-thiadiazol-2-amine
CID 404516
N-(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamide
CID 25154730

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The IUPAC name of 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride (CID 11971454) is 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The canonical SMILES for 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride is CCc1nnc(N)s1.Cl.
What is the InChIKey of 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
The InChIKey is CTMYXGFTKJIYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3S.ClH/c1-2-3-6-7-4(5)8-3;/h2H2,1H3,(H2,5,7);1H.
What are the key properties of 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride?
5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride has a molecular weight of 165.65 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,3,4-thiadiazol-2-amine;hydrochloride is sourced from PubChem (CID 11971454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).