N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine

C7H8N4OS — CID 130586021

IUPACN-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine
SMILESCc1cc(CNc2cnns2)on1
InChIInChI=1S/C7H8N4OS/c1-5-2-6(12-10-5)3-8-7-4-9-11-13-7/h2,4,8H,3H2,1H3
InChIKeyMIZKGVSJENCFAB-UHFFFAOYSA-N
MW196.24 g/mol
LogP1.45
Rot. Bonds3

About N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine

N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine (PubChem CID 130586021) has the molecular formula C7H8N4OS and a molecular weight of 196.24 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine
PubChem CID130586021
Molecular FormulaC7H8N4OS
Molecular Weight196.24 g/mol
Exact Mass196.04
IUPAC NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine
SMILESCc1cc(CNc2cnns2)on1
InChIInChI=1S/C7H8N4OS/c1-5-2-6(12-10-5)3-8-7-4-9-11-13-7/h2,4,8H,3H2,1H3
InChIKeyMIZKGVSJENCFAB-UHFFFAOYSA-N
XLogP1.45
TPSA63.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.24
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine 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 N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine?
The IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine (CID 130586021) is N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine is Cc1cc(CNc2cnns2)on1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine?
The InChIKey is MIZKGVSJENCFAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4OS/c1-5-2-6(12-10-5)3-8-7-4-9-11-13-7/h2,4,8H,3H2,1H3.
What are the key properties of N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine?
N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine has a molecular weight of 196.24 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-5-yl)methyl]thiadiazol-5-amine is sourced from PubChem (CID 130586021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).