3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine

C4H8N4S — CID 14359128

IUPAC3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine
SMILESCN(C)c1nsc(N)n1
InChIInChI=1S/C4H8N4S/c1-8(2)4-6-3(5)9-7-4/h1-2H3,(H2,5,6,7)
InChIKeyKFFXIDGFYLOKMF-UHFFFAOYSA-N
MW144.20 g/mol
LogP0.19
Rot. Bonds1

About 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine

3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine (PubChem CID 14359128) has the molecular formula C4H8N4S and a molecular weight of 144.20 g/mol. Its IUPAC name is 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine.

Molecular Properties

Compound Name3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine
PubChem CID14359128
Molecular FormulaC4H8N4S
Molecular Weight144.20 g/mol
Exact Mass144.05
IUPAC Name3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine
SMILESCN(C)c1nsc(N)n1
InChIInChI=1S/C4H8N4S/c1-8(2)4-6-3(5)9-7-4/h1-2H3,(H2,5,6,7)
InChIKeyKFFXIDGFYLOKMF-UHFFFAOYSA-N
XLogP0.19
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine?
The IUPAC name of 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine (CID 14359128) is 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine.
What is the SMILES notation for 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine?
The canonical SMILES for 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine is CN(C)c1nsc(N)n1.
What is the InChIKey of 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine?
The InChIKey is KFFXIDGFYLOKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4S/c1-8(2)4-6-3(5)9-7-4/h1-2H3,(H2,5,6,7).
What are the key properties of 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine?
3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine has a molecular weight of 144.20 g/mol, XLogP of 0.19, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,3-N-dimethyl-1,2,4-thiadiazole-3,5-diamine is sourced from PubChem (CID 14359128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).