5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine

C4H8N4S — CID 46318325

IUPAC5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine
SMILESCC(N)c1nnc(N)s1
InChIInChI=1S/C4H8N4S/c1-2(5)3-7-8-4(6)9-3/h2H,5H2,1H3,(H2,6,8)
InChIKeyGSVLRMMVNXHIMU-UHFFFAOYSA-N
MW144.20 g/mol
LogP0.14
Rot. Bonds1

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

5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine (PubChem CID 46318325) has the molecular formula C4H8N4S and a molecular weight of 144.20 g/mol. Its IUPAC name is 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine
PubChem CID46318325
Molecular FormulaC4H8N4S
Molecular Weight144.20 g/mol
Exact Mass144.05
IUPAC Name5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine
SMILESCC(N)c1nnc(N)s1
InChIInChI=1S/C4H8N4S/c1-2(5)3-7-8-4(6)9-3/h2H,5H2,1H3,(H2,6,8)
InChIKeyGSVLRMMVNXHIMU-UHFFFAOYSA-N
XLogP0.14
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(1-aminoethyl)-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-(1-aminoethyl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine (CID 46318325) is 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine is CC(N)c1nnc(N)s1.
What is the InChIKey of 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine?
The InChIKey is GSVLRMMVNXHIMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4S/c1-2(5)3-7-8-4(6)9-3/h2H,5H2,1H3,(H2,6,8).
What are the key properties of 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine?
5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine has a molecular weight of 144.20 g/mol, XLogP of 0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminoethyl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 46318325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).