thiadiazol-5-amine;dihydrochloride

C2H5Cl2N3S — CID 67486560

IUPACthiadiazol-5-amine;dihydrochloride
SMILESCl.Cl.Nc1cnns1
InChIInChI=1S/C2H3N3S.2ClH/c3-2-1-4-5-6-2;;/h1H,3H2;2*1H
InChIKeyZVWNJPNAJDLBKM-UHFFFAOYSA-N
MW174.06 g/mol
LogP0.96
Rot. Bonds

About thiadiazol-5-amine;dihydrochloride

thiadiazol-5-amine;dihydrochloride (PubChem CID 67486560) has the molecular formula C2H5Cl2N3S and a molecular weight of 174.06 g/mol. Its IUPAC name is thiadiazol-5-amine;dihydrochloride.

Molecular Properties

Compound Namethiadiazol-5-amine;dihydrochloride
PubChem CID67486560
Molecular FormulaC2H5Cl2N3S
Molecular Weight174.06 g/mol
Exact Mass172.96
IUPAC Namethiadiazol-5-amine;dihydrochloride
SMILESCl.Cl.Nc1cnns1
InChIInChI=1S/C2H3N3S.2ClH/c3-2-1-4-5-6-2;;/h1H,3H2;2*1H
InChIKeyZVWNJPNAJDLBKM-UHFFFAOYSA-N
XLogP0.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.06
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of thiadiazol-5-amine;dihydrochloride?
The IUPAC name of thiadiazol-5-amine;dihydrochloride (CID 67486560) is thiadiazol-5-amine;dihydrochloride.
What is the SMILES notation for thiadiazol-5-amine;dihydrochloride?
The canonical SMILES for thiadiazol-5-amine;dihydrochloride is Cl.Cl.Nc1cnns1.
What is the InChIKey of thiadiazol-5-amine;dihydrochloride?
The InChIKey is ZVWNJPNAJDLBKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3N3S.2ClH/c3-2-1-4-5-6-2;;/h1H,3H2;2*1H.
What are the key properties of thiadiazol-5-amine;dihydrochloride?
thiadiazol-5-amine;dihydrochloride has a molecular weight of 174.06 g/mol, XLogP of 0.96, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for thiadiazol-5-amine;dihydrochloride is sourced from PubChem (CID 67486560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).