5-(azetidin-3-ylmethyl)thiadiazole

C6H9N3S — CID 130600555

IUPAC5-(azetidin-3-ylmethyl)thiadiazole
SMILESc1nnsc1CC1CNC1
InChIInChI=1S/C6H9N3S/c1(5-2-7-3-5)6-4-8-9-10-6/h4-5,7H,1-3H2
InChIKeyHWMOMJWPYXHAAV-UHFFFAOYSA-N
MW155.23 g/mol
LogP0.30
Rot. Bonds2

About 5-(azetidin-3-ylmethyl)thiadiazole

5-(azetidin-3-ylmethyl)thiadiazole (PubChem CID 130600555) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is 5-(azetidin-3-ylmethyl)thiadiazole.

Molecular Properties

Compound Name5-(azetidin-3-ylmethyl)thiadiazole
PubChem CID130600555
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC Name5-(azetidin-3-ylmethyl)thiadiazole
SMILESc1nnsc1CC1CNC1
InChIInChI=1S/C6H9N3S/c1(5-2-7-3-5)6-4-8-9-10-6/h4-5,7H,1-3H2
InChIKeyHWMOMJWPYXHAAV-UHFFFAOYSA-N
XLogP0.30
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(azetidin-3-ylmethyl)thiadiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(azetidin-3-ylmethyl)thiadiazole?
The IUPAC name of 5-(azetidin-3-ylmethyl)thiadiazole (CID 130600555) is 5-(azetidin-3-ylmethyl)thiadiazole.
What is the SMILES notation for 5-(azetidin-3-ylmethyl)thiadiazole?
The canonical SMILES for 5-(azetidin-3-ylmethyl)thiadiazole is c1nnsc1CC1CNC1.
What is the InChIKey of 5-(azetidin-3-ylmethyl)thiadiazole?
The InChIKey is HWMOMJWPYXHAAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3S/c1(5-2-7-3-5)6-4-8-9-10-6/h4-5,7H,1-3H2.
What are the key properties of 5-(azetidin-3-ylmethyl)thiadiazole?
5-(azetidin-3-ylmethyl)thiadiazole has a molecular weight of 155.23 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azetidin-3-ylmethyl)thiadiazole is sourced from PubChem (CID 130600555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).