5-cyclopropyl-1,2,4-thiadiazol-3-amine

C5H7N3S — CID 64538822

IUPAC5-cyclopropyl-1,2,4-thiadiazol-3-amine
SMILESNc1nsc(C2CC2)n1
InChIInChI=1S/C5H7N3S/c6-5-7-4(9-8-5)3-1-2-3/h3H,1-2H2,(H2,6,8)
InChIKeyRTIQQISXSFOOIK-UHFFFAOYSA-N
MW141.20 g/mol
LogP1.00
Rot. Bonds1

About 5-cyclopropyl-1,2,4-thiadiazol-3-amine

5-cyclopropyl-1,2,4-thiadiazol-3-amine (PubChem CID 64538822) has the molecular formula C5H7N3S and a molecular weight of 141.20 g/mol. Its IUPAC name is 5-cyclopropyl-1,2,4-thiadiazol-3-amine.

Molecular Properties

Compound Name5-cyclopropyl-1,2,4-thiadiazol-3-amine
PubChem CID64538822
Molecular FormulaC5H7N3S
Molecular Weight141.20 g/mol
Exact Mass141.04
IUPAC Name5-cyclopropyl-1,2,4-thiadiazol-3-amine
SMILESNc1nsc(C2CC2)n1
InChIInChI=1S/C5H7N3S/c6-5-7-4(9-8-5)3-1-2-3/h3H,1-2H2,(H2,6,8)
InChIKeyRTIQQISXSFOOIK-UHFFFAOYSA-N
XLogP1.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.20
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1,2,4-thiadiazol-3-amine?
The IUPAC name of 5-cyclopropyl-1,2,4-thiadiazol-3-amine (CID 64538822) is 5-cyclopropyl-1,2,4-thiadiazol-3-amine.
What is the SMILES notation for 5-cyclopropyl-1,2,4-thiadiazol-3-amine?
The canonical SMILES for 5-cyclopropyl-1,2,4-thiadiazol-3-amine is Nc1nsc(C2CC2)n1.
What is the InChIKey of 5-cyclopropyl-1,2,4-thiadiazol-3-amine?
The InChIKey is RTIQQISXSFOOIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3S/c6-5-7-4(9-8-5)3-1-2-3/h3H,1-2H2,(H2,6,8).
What are the key properties of 5-cyclopropyl-1,2,4-thiadiazol-3-amine?
5-cyclopropyl-1,2,4-thiadiazol-3-amine has a molecular weight of 141.20 g/mol, XLogP of 1.00, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1,2,4-thiadiazol-3-amine is sourced from PubChem (CID 64538822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).