4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine

C8H8N4S2 — CID 122154731

IUPAC4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine
SMILESNc1snnc1-c1nc(C2CC2)cs1
InChIInChI=1S/C8H8N4S2/c9-7-6(11-12-14-7)8-10-5(3-13-8)4-1-2-4/h3-4H,1-2,9H2
InChIKeyVLZSLVAUXPBCDE-UHFFFAOYSA-N
MW224.31 g/mol
LogP2.12
Rot. Bonds2

About 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine

4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine (PubChem CID 122154731) has the molecular formula C8H8N4S2 and a molecular weight of 224.31 g/mol. Its IUPAC name is 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine.

Molecular Properties

Compound Name4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine
PubChem CID122154731
Molecular FormulaC8H8N4S2
Molecular Weight224.31 g/mol
Exact Mass224.02
IUPAC Name4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine
SMILESNc1snnc1-c1nc(C2CC2)cs1
InChIInChI=1S/C8H8N4S2/c9-7-6(11-12-14-7)8-10-5(3-13-8)4-1-2-4/h3-4H,1-2,9H2
InChIKeyVLZSLVAUXPBCDE-UHFFFAOYSA-N
XLogP2.12
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine?
The IUPAC name of 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine (CID 122154731) is 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine.
What is the SMILES notation for 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine?
The canonical SMILES for 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine is Nc1snnc1-c1nc(C2CC2)cs1.
What is the InChIKey of 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine?
The InChIKey is VLZSLVAUXPBCDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4S2/c9-7-6(11-12-14-7)8-10-5(3-13-8)4-1-2-4/h3-4H,1-2,9H2.
What are the key properties of 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine?
4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine has a molecular weight of 224.31 g/mol, XLogP of 2.12, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyclopropyl-1,3-thiazol-2-yl)thiadiazol-5-amine is sourced from PubChem (CID 122154731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).