3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine

C6H10FN3S — CID 130478087

IUPAC3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine
SMILESCCc1nsc(NCCF)n1
InChIInChI=1S/C6H10FN3S/c1-2-5-9-6(11-10-5)8-4-3-7/h2-4H2,1H3,(H,8,9,10)
InChIKeyWNTJPHNRBZUZMC-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.48
Rot. Bonds4

About 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine

3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine (PubChem CID 130478087) has the molecular formula C6H10FN3S and a molecular weight of 175.23 g/mol. Its IUPAC name is 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine
PubChem CID130478087
Molecular FormulaC6H10FN3S
Molecular Weight175.23 g/mol
Exact Mass175.06
IUPAC Name3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine
SMILESCCc1nsc(NCCF)n1
InChIInChI=1S/C6H10FN3S/c1-2-5-9-6(11-10-5)8-4-3-7/h2-4H2,1H3,(H,8,9,10)
InChIKeyWNTJPHNRBZUZMC-UHFFFAOYSA-N
XLogP1.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-(3-ethyl-1,2,4-thiadiazol-5-yl)propane-1,3-diamine
CID 65272512
N-(4-chlorobutyl)-3-ethyl-1,2,4-thiadiazol-5-amine
CID 106845066
3-ethyl-N-(4-methylpentyl)-1,2,4-thiadiazol-5-amine
CID 65271707
2-[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]acetonitrile
CID 131134565
N'-(3-ethyl-1,2,4-thiadiazol-5-yl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 83039936
N-[2-(2-chloroethoxy)ethyl]-3-ethyl-1,2,4-thiadiazol-5-amine
CID 65277932
N-(2-cyclohexylethyl)-3-ethyl-1,2,4-thiadiazol-5-amine
CID 65271632
N-[2-(4-chlorophenyl)ethyl]-3-ethyl-1,2,4-thiadiazol-5-amine
CID 65277041
N-[[2-(aminomethyl)phenyl]methyl]-3-ethyl-1,2,4-thiadiazol-5-amine
CID 65275887
N-(2-cyclopentyloxyethyl)-3-ethyl-1,2,4-thiadiazol-5-amine
CID 65273869
N'-cyclopropyl-N'-ethyl-N-(3-ethyl-1,2,4-thiadiazol-5-yl)ethane-1,2-diamine
CID 103739545
3-[(dimethylamino)methyl]-N-propyl-1,2,4-thiadiazol-5-amine
CID 79084999

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine (CID 130478087) is 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine is CCc1nsc(NCCF)n1.
What is the InChIKey of 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine?
The InChIKey is WNTJPHNRBZUZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10FN3S/c1-2-5-9-6(11-10-5)8-4-3-7/h2-4H2,1H3,(H,8,9,10).
What are the key properties of 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine?
3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine has a molecular weight of 175.23 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-fluoroethyl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 130478087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).