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

C7H10FN3S — CID 130658627

IUPAC5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine
SMILESFCCNc1nnc(C2CC2)s1
InChIInChI=1S/C7H10FN3S/c8-3-4-9-7-11-10-6(12-7)5-1-2-5/h5H,1-4H2,(H,9,11)
InChIKeyJGFMEEVETOZDNJ-UHFFFAOYSA-N
MW187.24 g/mol
LogP1.80
Rot. Bonds4

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

5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine (PubChem CID 130658627) has the molecular formula C7H10FN3S and a molecular weight of 187.24 g/mol. Its IUPAC name is 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine
PubChem CID130658627
Molecular FormulaC7H10FN3S
Molecular Weight187.24 g/mol
Exact Mass187.06
IUPAC Name5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine
SMILESFCCNc1nnc(C2CC2)s1
InChIInChI=1S/C7H10FN3S/c8-3-4-9-7-11-10-6(12-7)5-1-2-5/h5H,1-4H2,(H,9,11)
InChIKeyJGFMEEVETOZDNJ-UHFFFAOYSA-N
XLogP1.80
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine (CID 130658627) is 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine is FCCNc1nnc(C2CC2)s1.
What is the InChIKey of 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine?
The InChIKey is JGFMEEVETOZDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3S/c8-3-4-9-7-11-10-6(12-7)5-1-2-5/h5H,1-4H2,(H,9,11).
What are the key properties of 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine?
5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine has a molecular weight of 187.24 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-N-(2-fluoroethyl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 130658627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).