N'-acetylthiophene-3-carbohydrazide

C7H8N2O2S — CID 123302382

IUPACN'-acetylthiophene-3-carbohydrazide
SMILESCC(=O)NNC(=O)c1ccsc1
InChIInChI=1S/C7H8N2O2S/c1-5(10)8-9-7(11)6-2-3-12-4-6/h2-4H,1H3,(H,8,10)(H,9,11)
InChIKeySTQQMAZYVWHXJT-UHFFFAOYSA-N
MW184.22 g/mol
LogP0.53
Rot. Bonds1

About N'-acetylthiophene-3-carbohydrazide

N'-acetylthiophene-3-carbohydrazide (PubChem CID 123302382) has the molecular formula C7H8N2O2S and a molecular weight of 184.22 g/mol. Its IUPAC name is N'-acetylthiophene-3-carbohydrazide.

Molecular Properties

Compound NameN'-acetylthiophene-3-carbohydrazide
PubChem CID123302382
Molecular FormulaC7H8N2O2S
Molecular Weight184.22 g/mol
Exact Mass184.03
IUPAC NameN'-acetylthiophene-3-carbohydrazide
SMILESCC(=O)NNC(=O)c1ccsc1
InChIInChI=1S/C7H8N2O2S/c1-5(10)8-9-7(11)6-2-3-12-4-6/h2-4H,1H3,(H,8,10)(H,9,11)
InChIKeySTQQMAZYVWHXJT-UHFFFAOYSA-N
XLogP0.53
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.22
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-acetylthiophene-3-carbohydrazide 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

Thiophene-3-carboxamide
CID 11205757
Thiophene-3-carbohydrazide
CID 468648
thiophene-3-carboxylic acid N'-isopropyl-hydrazide
CID 59642162
1-Methyl-3-(thiophene-3-carbonylamino)thiourea
CID 2820647
N-diaminophosphorylthiophene-3-carboxamide
CID 18938065
5-Bromo-3-thiophenecarboxylic acid hydrazide
CID 43132219
Thiophene-3,4-dicarbohydrazide
CID 53715988
2-Bromothiophene-3-carbohydrazide
CID 59152527
(Thiophene-3-carbonylamino)urea
CID 64207645
Thiophene-3-carboxamide;hydrochloride
CID 67696565
(2S)-2-[2-(thiophene-3-carbonyl)hydrazinyl]propanoic acid
CID 70246815
N-methylthiophene-3-carbohydrazide
CID 90882148

Frequently Asked Questions

What is the IUPAC name of N'-acetylthiophene-3-carbohydrazide?
The IUPAC name of N'-acetylthiophene-3-carbohydrazide (CID 123302382) is N'-acetylthiophene-3-carbohydrazide.
What is the SMILES notation for N'-acetylthiophene-3-carbohydrazide?
The canonical SMILES for N'-acetylthiophene-3-carbohydrazide is CC(=O)NNC(=O)c1ccsc1.
What is the InChIKey of N'-acetylthiophene-3-carbohydrazide?
The InChIKey is STQQMAZYVWHXJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2S/c1-5(10)8-9-7(11)6-2-3-12-4-6/h2-4H,1H3,(H,8,10)(H,9,11).
What are the key properties of N'-acetylthiophene-3-carbohydrazide?
N'-acetylthiophene-3-carbohydrazide has a molecular weight of 184.22 g/mol, XLogP of 0.53, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-acetylthiophene-3-carbohydrazide is sourced from PubChem (CID 123302382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).