2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine

C6H11N3S — CID 65280810

IUPAC2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine
SMILESCCc1nsc(CCN)n1
InChIInChI=1S/C6H11N3S/c1-2-5-8-6(3-4-7)10-9-5/h2-4,7H2,1H3
InChIKeyLIRCONDFYRUHLD-UHFFFAOYSA-N
MW157.24 g/mol
LogP0.60
Rot. Bonds3

About 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine

2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine (PubChem CID 65280810) has the molecular formula C6H11N3S and a molecular weight of 157.24 g/mol. Its IUPAC name is 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine
PubChem CID65280810
Molecular FormulaC6H11N3S
Molecular Weight157.24 g/mol
Exact Mass157.07
IUPAC Name2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine
SMILESCCc1nsc(CCN)n1
InChIInChI=1S/C6H11N3S/c1-2-5-8-6(3-4-7)10-9-5/h2-4,7H2,1H3
InChIKeyLIRCONDFYRUHLD-UHFFFAOYSA-N
XLogP0.60
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.24
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Methyl-5-pyrrolidin-3-yl-1,2,4-thiadiazole
CID 14763513
5-Ethyl-1,2,4-thiadiazol-3-amine
CID 12246463
2-(3-Methyl-1,2,4-thiadiazol-5-yl)propan-2-amine
CID 86674740
3,5-Diethyl-1,2,4-thiadiazole
CID 67571441
5-Amino-3-(2-aminopropyl)-1,2,4-thiadiazole
CID 83872911
3-methyl-N-propyl-1,2,4-thiadiazol-5-amine
CID 65269099
3,3,3-Trifluoro-2-(3-methyl-1,2,4-thiadiazol-5-yl)propan-1-amine
CID 82394683
1-[5-(Trifluoromethyl)-1,2,4-thiadiazol-3-yl]ethanamine
CID 82399161
2-[5-(Trifluoromethyl)-1,2,4-thiadiazol-3-yl]ethanamine
CID 82399162
2-[3-(Trifluoromethyl)-1,2,4-thiadiazol-5-yl]ethanamine
CID 82399163
N-[[5-(trifluoromethyl)-1,2,4-thiadiazol-3-yl]methyl]propan-1-amine
CID 83959832
2-Fluoro-2-(3-methyl-1,2,4-thiadiazol-5-yl)propan-1-amine
CID 84022031

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine?
The IUPAC name of 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine (CID 65280810) is 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine?
The canonical SMILES for 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine is CCc1nsc(CCN)n1.
What is the InChIKey of 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine?
The InChIKey is LIRCONDFYRUHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3S/c1-2-5-8-6(3-4-7)10-9-5/h2-4,7H2,1H3.
What are the key properties of 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine?
2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine has a molecular weight of 157.24 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-1,2,4-thiadiazol-5-yl)ethanamine is sourced from PubChem (CID 65280810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).