2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide

C13H11N3O3S — CID 171982887

IUPAC2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide
SMILESO=C(NNC(=O)c1cccs1)C(=O)Nc1ccccc1
InChIInChI=1S/C13H11N3O3S/c17-11(10-7-4-8-20-10)15-16-13(19)12(18)14-9-5-2-1-3-6-9/h1-8H,(H,14,18)(H,15,17)(H,16,19)
InChIKeyGRIJSSQHGYWFPT-UHFFFAOYSA-N
MW289.32 g/mol
LogP1.15
Rot. Bonds2

About 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide

2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide (PubChem CID 171982887) has the molecular formula C13H11N3O3S and a molecular weight of 289.32 g/mol. Its IUPAC name is 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide.

Molecular Properties

Compound Name2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide
PubChem CID171982887
Molecular FormulaC13H11N3O3S
Molecular Weight289.32 g/mol
Exact Mass289.05
IUPAC Name2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide
SMILESO=C(NNC(=O)c1cccs1)C(=O)Nc1ccccc1
InChIInChI=1S/C13H11N3O3S/c17-11(10-7-4-8-20-10)15-16-13(19)12(18)14-9-5-2-1-3-6-9/h1-8H,(H,14,18)(H,15,17)(H,16,19)
InChIKeyGRIJSSQHGYWFPT-UHFFFAOYSA-N
XLogP1.15
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.32
LogP ≤ 51.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(phenylcarbamothioyl)thiophene-2-carboxamide
CID 817333
N-[4-[(thiophene-2-carbonylamino)carbamoyl]phenyl]thiophene-2-carboxamide
CID 1117998
N-[4-[(thiophene-2-carbonylamino)carbamoyl]phenyl]acetamide
CID 809220
N'-(1-phenylethenyl)thiophene-2-carbohydrazide
CID 2715132
N-(1-anilino-1-oxopropan-2-yl)thiophene-2-carboxamide
CID 42929942
N-[4-[4-(thiophene-2-carbonylamino)anilino]phenyl]thiophene-2-carboxamide
CID 67687159
1-N',4-N'-bis(thiophene-2-carbonyl)butanedihydrazide
CID 3715888
N-(anilinocarbamothioyl)thiophene-2-carboxamide
CID 17100252
1-(4-bromophenyl)-3-(thiophene-2-carbonylamino)thiourea
CID 18708934
1-(4-chlorophenyl)-3-(thiophene-2-carbonylamino)thiourea
CID 848929
1-amino-3-(thiophene-2-carbonylamino)urea
CID 141065921
N-[2-oxo-2-[2-(phenylcarbamothioyl)hydrazinyl]ethyl]thiophene-2-carboxamide
CID 18273574

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide?
The IUPAC name of 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide (CID 171982887) is 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide.
What is the SMILES notation for 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide?
The canonical SMILES for 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide is O=C(NNC(=O)c1cccs1)C(=O)Nc1ccccc1.
What is the InChIKey of 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide?
The InChIKey is GRIJSSQHGYWFPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O3S/c17-11(10-7-4-8-20-10)15-16-13(19)12(18)14-9-5-2-1-3-6-9/h1-8H,(H,14,18)(H,15,17)(H,16,19).
What are the key properties of 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide?
2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide has a molecular weight of 289.32 g/mol, XLogP of 1.15, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-phenyl-2-[2-(thiophene-2-carbonyl)hydrazinyl]acetamide is sourced from PubChem (CID 171982887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).