2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol

C4H7N3OS — CID 45078915

IUPAC2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol
SMILESNc1nc(CCO)ns1
InChIInChI=1S/C4H7N3OS/c5-4-6-3(1-2-8)7-9-4/h8H,1-2H2,(H2,5,6,7)
InChIKeyGFRLQKGTUZQVSG-UHFFFAOYSA-N
MW145.19 g/mol
LogP-0.34
Rot. Bonds2

About 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol

2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol (PubChem CID 45078915) has the molecular formula C4H7N3OS and a molecular weight of 145.19 g/mol. Its IUPAC name is 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol
PubChem CID45078915
Molecular FormulaC4H7N3OS
Molecular Weight145.19 g/mol
Exact Mass145.03
IUPAC Name2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol
SMILESNc1nc(CCO)ns1
InChIInChI=1S/C4H7N3OS/c5-4-6-3(1-2-8)7-9-4/h8H,1-2H2,(H2,5,6,7)
InChIKeyGFRLQKGTUZQVSG-UHFFFAOYSA-N
XLogP-0.34
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.19
LogP ≤ 5-0.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol with MolForge

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

Launch Full Analysis

Related Compounds

3-(2-Methoxyethyl)-1,2,4-thiadiazol-5-amine
CID 61412549
O-[2-(5-amino-1,2,4-thiadiazol-3-yl)ethyl]hydroxylamine
CID 17874157
1-(5-Amino-1,2,4-thiadiazol-3-yl)propan-2-ol
CID 21081457
2-(3-Methyl-1,2,4-thiadiazol-5-yl)ethanol
CID 83674191
(1S)-1-(5-amino-1,2,4-thiadiazol-3-yl)ethane-1,2-diol
CID 118451831
1-(5-Amino-1,2,4-thiadiazol-3-yl)-2-methylpropan-2-ol
CID 169591977
1-(5-Amino-1,2,4-thiadiazol-3-yl)ethanol
CID 174248175
2-(5-Amino-1,2,4-thiadiazol-3-yl)ethyl cyanomethanimidate
CID 174721936
3-[(3-Ethyl-1,2,4-thiadiazol-5-yl)amino]propan-1-ol
CID 65271148
(5-Amino-1,2,4-thiadiazol-3-yl)methanol
CID 83872226
3-(2-Methoxypropyl)-1,2,4-thiadiazol-5-amine
CID 104249096
3-(2-Ethoxyethyl)-1,2,4-thiadiazol-5-amine
CID 106814918

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol?
The IUPAC name of 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol (CID 45078915) is 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol.
What is the SMILES notation for 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol?
The canonical SMILES for 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol is Nc1nc(CCO)ns1.
What is the InChIKey of 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol?
The InChIKey is GFRLQKGTUZQVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7N3OS/c5-4-6-3(1-2-8)7-9-4/h8H,1-2H2,(H2,5,6,7).
What are the key properties of 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol?
2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol has a molecular weight of 145.19 g/mol, XLogP of -0.34, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1,2,4-thiadiazol-3-yl)ethanol is sourced from PubChem (CID 45078915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).