N-methyl-4-(thiadiazol-4-yl)benzamide

C10H9N3OS — CID 22103625

IUPACN-methyl-4-(thiadiazol-4-yl)benzamide
SMILESCNC(=O)c1ccc(-c2csnn2)cc1
InChIInChI=1S/C10H9N3OS/c1-11-10(14)8-4-2-7(3-5-8)9-6-15-13-12-9/h2-6H,1H3,(H,11,14)
InChIKeyKDFSLWIKHGDXOC-UHFFFAOYSA-N
MW219.27 g/mol
LogP1.56
Rot. Bonds2

About N-methyl-4-(thiadiazol-4-yl)benzamide

N-methyl-4-(thiadiazol-4-yl)benzamide (PubChem CID 22103625) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is N-methyl-4-(thiadiazol-4-yl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(thiadiazol-4-yl)benzamide
PubChem CID22103625
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC NameN-methyl-4-(thiadiazol-4-yl)benzamide
SMILESCNC(=O)c1ccc(-c2csnn2)cc1
InChIInChI=1S/C10H9N3OS/c1-11-10(14)8-4-2-7(3-5-8)9-6-15-13-12-9/h2-6H,1H3,(H,11,14)
InChIKeyKDFSLWIKHGDXOC-UHFFFAOYSA-N
XLogP1.56
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-(thiadiazol-4-yl)benzamide 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-methyl-4-(thiadiazol-4-yl)benzamide?
The IUPAC name of N-methyl-4-(thiadiazol-4-yl)benzamide (CID 22103625) is N-methyl-4-(thiadiazol-4-yl)benzamide.
What is the SMILES notation for N-methyl-4-(thiadiazol-4-yl)benzamide?
The canonical SMILES for N-methyl-4-(thiadiazol-4-yl)benzamide is CNC(=O)c1ccc(-c2csnn2)cc1.
What is the InChIKey of N-methyl-4-(thiadiazol-4-yl)benzamide?
The InChIKey is KDFSLWIKHGDXOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c1-11-10(14)8-4-2-7(3-5-8)9-6-15-13-12-9/h2-6H,1H3,(H,11,14).
What are the key properties of N-methyl-4-(thiadiazol-4-yl)benzamide?
N-methyl-4-(thiadiazol-4-yl)benzamide has a molecular weight of 219.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(thiadiazol-4-yl)benzamide is sourced from PubChem (CID 22103625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).