N-carbamoyl-2-(thiadiazol-5-yl)benzamide

C10H8N4O2S — CID 174604960

IUPACN-carbamoyl-2-(thiadiazol-5-yl)benzamide
SMILESNC(=O)NC(=O)c1ccccc1-c1cnns1
InChIInChI=1S/C10H8N4O2S/c11-10(16)13-9(15)7-4-2-1-3-6(7)8-5-12-14-17-8/h1-5H,(H3,11,13,15,16)
InChIKeyDOSGACMQGLPQDG-UHFFFAOYSA-N
MW248.27 g/mol
LogP1.01
Rot. Bonds2

About N-carbamoyl-2-(thiadiazol-5-yl)benzamide

N-carbamoyl-2-(thiadiazol-5-yl)benzamide (PubChem CID 174604960) has the molecular formula C10H8N4O2S and a molecular weight of 248.27 g/mol. Its IUPAC name is N-carbamoyl-2-(thiadiazol-5-yl)benzamide.

Molecular Properties

Compound NameN-carbamoyl-2-(thiadiazol-5-yl)benzamide
PubChem CID174604960
Molecular FormulaC10H8N4O2S
Molecular Weight248.27 g/mol
Exact Mass248.04
IUPAC NameN-carbamoyl-2-(thiadiazol-5-yl)benzamide
SMILESNC(=O)NC(=O)c1ccccc1-c1cnns1
InChIInChI=1S/C10H8N4O2S/c11-10(16)13-9(15)7-4-2-1-3-6(7)8-5-12-14-17-8/h1-5H,(H3,11,13,15,16)
InChIKeyDOSGACMQGLPQDG-UHFFFAOYSA-N
XLogP1.01
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(thiadiazol-5-yl)benzamide?
The IUPAC name of N-carbamoyl-2-(thiadiazol-5-yl)benzamide (CID 174604960) is N-carbamoyl-2-(thiadiazol-5-yl)benzamide.
What is the SMILES notation for N-carbamoyl-2-(thiadiazol-5-yl)benzamide?
The canonical SMILES for N-carbamoyl-2-(thiadiazol-5-yl)benzamide is NC(=O)NC(=O)c1ccccc1-c1cnns1.
What is the InChIKey of N-carbamoyl-2-(thiadiazol-5-yl)benzamide?
The InChIKey is DOSGACMQGLPQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O2S/c11-10(16)13-9(15)7-4-2-1-3-6(7)8-5-12-14-17-8/h1-5H,(H3,11,13,15,16).
What are the key properties of N-carbamoyl-2-(thiadiazol-5-yl)benzamide?
N-carbamoyl-2-(thiadiazol-5-yl)benzamide has a molecular weight of 248.27 g/mol, XLogP of 1.01, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(thiadiazol-5-yl)benzamide is sourced from PubChem (CID 174604960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).