2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide

C10H9N3OS — CID 1147600

IUPAC2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nncs1
InChIInChI=1S/C10H9N3OS/c1-7-4-2-3-5-8(7)9(14)12-10-13-11-6-15-10/h2-6H,1H3,(H,12,13,14)
InChIKeyWMKRJLRISMFCDM-UHFFFAOYSA-N
MW219.27 g/mol
LogP2.10
Rot. Bonds2

About 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide

2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide (PubChem CID 1147600) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide
PubChem CID1147600
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC Name2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide
SMILESCc1ccccc1C(=O)Nc1nncs1
InChIInChI=1S/C10H9N3OS/c1-7-4-2-3-5-8(7)9(14)12-10-13-11-6-15-10/h2-6H,1H3,(H,12,13,14)
InChIKeyWMKRJLRISMFCDM-UHFFFAOYSA-N
XLogP2.10
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 ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-(1,3,4-thiadiazol-2-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

Related Compounds

4-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 676913
N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide
CID 953455
N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
CID 803498
N-(5-(isopropylthio)-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
CID 7095467
N-(1,3,4-Thiadiazol-2-yl)benzamide
CID 569548
2-phenyl-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 821620
N-[(2-methyltetrazol-5-yl)carbamothioyl]naphthalene-1-carboxamide
CID 938551
4-methyl-N-(2-methyl-5-tetrazolyl)benzamide
CID 653643
N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
CID 871615
1-phenyl-N-(1,3,4-thiadiazol-2-yl)cyclopentane-1-carboxamide
CID 976753
N-(2-methyl-2H-tetrazol-5-yl)benzamide
CID 953429
2-(1,3,4-Thiadiazol-2-yl)-1,2-benzoselenazol-3-one
CID 85906819

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The IUPAC name of 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide (CID 1147600) is 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide.
What is the SMILES notation for 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The canonical SMILES for 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide is Cc1ccccc1C(=O)Nc1nncs1.
What is the InChIKey of 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
The InChIKey is WMKRJLRISMFCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c1-7-4-2-3-5-8(7)9(14)12-10-13-11-6-15-10/h2-6H,1H3,(H,12,13,14).
What are the key properties of 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide?
2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide has a molecular weight of 219.27 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,3,4-thiadiazol-2-yl)benzamide is sourced from PubChem (CID 1147600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).