5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine

C5H10N4S — CID 51072256

IUPAC5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine
SMILESCC(C)(N)c1nnc(N)s1
InChIInChI=1S/C5H10N4S/c1-5(2,7)3-8-9-4(6)10-3/h7H2,1-2H3,(H2,6,9)
InChIKeyNQDVFRNQGHUBHO-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.31
Rot. Bonds1

About 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine

5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine (PubChem CID 51072256) has the molecular formula C5H10N4S and a molecular weight of 158.23 g/mol. Its IUPAC name is 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine
PubChem CID51072256
Molecular FormulaC5H10N4S
Molecular Weight158.23 g/mol
Exact Mass158.06
IUPAC Name5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine
SMILESCC(C)(N)c1nnc(N)s1
InChIInChI=1S/C5H10N4S/c1-5(2,7)3-8-9-4(6)10-3/h7H2,1-2H3,(H2,6,9)
InChIKeyNQDVFRNQGHUBHO-UHFFFAOYSA-N
XLogP0.31
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine (CID 51072256) is 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine is CC(C)(N)c1nnc(N)s1.
What is the InChIKey of 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine?
The InChIKey is NQDVFRNQGHUBHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4S/c1-5(2,7)3-8-9-4(6)10-3/h7H2,1-2H3,(H2,6,9).
What are the key properties of 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine?
5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine has a molecular weight of 158.23 g/mol, XLogP of 0.31, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropan-2-yl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 51072256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).