N-[4-(thiadiazol-4-yl)phenyl]acetamide

C10H9N3OS — CID 2739180

IUPACN-[4-(thiadiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2csnn2)cc1
InChIInChI=1S/C10H9N3OS/c1-7(14)11-9-4-2-8(3-5-9)10-6-15-13-12-10/h2-6H,1H3,(H,11,14)
InChIKeyLTYUTWUXLFWPKX-UHFFFAOYSA-N
MW219.27 g/mol
LogP2.16
Rot. Bonds2

About N-[4-(thiadiazol-4-yl)phenyl]acetamide

N-[4-(thiadiazol-4-yl)phenyl]acetamide (PubChem CID 2739180) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is N-[4-(thiadiazol-4-yl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(thiadiazol-4-yl)phenyl]acetamide
PubChem CID2739180
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC NameN-[4-(thiadiazol-4-yl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(-c2csnn2)cc1
InChIInChI=1S/C10H9N3OS/c1-7(14)11-9-4-2-8(3-5-9)10-6-15-13-12-10/h2-6H,1H3,(H,11,14)
InChIKeyLTYUTWUXLFWPKX-UHFFFAOYSA-N
XLogP2.16
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 ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(thiadiazol-4-yl)phenyl]acetamide 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-[4-(thiadiazol-4-yl)phenyl]acetamide?
The IUPAC name of N-[4-(thiadiazol-4-yl)phenyl]acetamide (CID 2739180) is N-[4-(thiadiazol-4-yl)phenyl]acetamide.
What is the SMILES notation for N-[4-(thiadiazol-4-yl)phenyl]acetamide?
The canonical SMILES for N-[4-(thiadiazol-4-yl)phenyl]acetamide is CC(=O)Nc1ccc(-c2csnn2)cc1.
What is the InChIKey of N-[4-(thiadiazol-4-yl)phenyl]acetamide?
The InChIKey is LTYUTWUXLFWPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c1-7(14)11-9-4-2-8(3-5-9)10-6-15-13-12-10/h2-6H,1H3,(H,11,14).
What are the key properties of N-[4-(thiadiazol-4-yl)phenyl]acetamide?
N-[4-(thiadiazol-4-yl)phenyl]acetamide has a molecular weight of 219.27 g/mol, XLogP of 2.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(thiadiazol-4-yl)phenyl]acetamide is sourced from PubChem (CID 2739180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).