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

C3H6ClN3S — CID 70700749

IUPAC3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride
SMILESCc1nsc(N)n1.Cl
InChIInChI=1S/C3H5N3S.ClH/c1-2-5-3(4)7-6-2;/h1H3,(H2,4,5,6);1H
InChIKeyGFGNCNSKFSGGCA-UHFFFAOYSA-N
MW151.62 g/mol
LogP0.85
Rot. Bonds

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

3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride (PubChem CID 70700749) has the molecular formula C3H6ClN3S and a molecular weight of 151.62 g/mol. Its IUPAC name is 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride.

Molecular Properties

Compound Name3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride
PubChem CID70700749
Molecular FormulaC3H6ClN3S
Molecular Weight151.62 g/mol
Exact Mass151.00
IUPAC Name3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride
SMILESCc1nsc(N)n1.Cl
InChIInChI=1S/C3H5N3S.ClH/c1-2-5-3(4)7-6-2;/h1H3,(H2,4,5,6);1H
InChIKeyGFGNCNSKFSGGCA-UHFFFAOYSA-N
XLogP0.85
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.62
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(Propan-2-yl)-1,2,4-thiadiazol-5-amine
CID 581957
3-Propyl-1,2,4-thiadiazol-5-amine
CID 575489
5-Amino-3-methyl-1,2,4-thiadiazole
CID 350639
5-Methyl-1,2,4-thiadiazol-3-amine
CID 12246462
5-Chloro-3-methyl-1,2,4-thiadiazole
CID 12919159
5-Amino-3-ethyl-1,2,4-thiadiazole
CID 2756430
3-(Difluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105429510
5-Hydrazinyl-3-methyl-1,2,4-thiadiazole
CID 582451
3-(1-Fluoroethyl)-1,2,4-thiadiazol-5-amine
CID 174597237
3-(Methylsulfanylmethyl)-1,2,4-thiadiazol-5-amine
CID 62691499
3-(Fluoromethyl)-1,2,4-thiadiazol-5-amine
CID 105427719
N,3-Dimethyl-1,2,4-thiadiazol-5-amine
CID 12725101

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride?
The IUPAC name of 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride (CID 70700749) is 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride.
What is the SMILES notation for 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride?
The canonical SMILES for 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride is Cc1nsc(N)n1.Cl.
What is the InChIKey of 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride?
The InChIKey is GFGNCNSKFSGGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5N3S.ClH/c1-2-5-3(4)7-6-2;/h1H3,(H2,4,5,6);1H.
What are the key properties of 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride?
3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride has a molecular weight of 151.62 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,2,4-thiadiazol-5-amine;hydrochloride is sourced from PubChem (CID 70700749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).