4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide

C14H14N2O2S — CID 2672376

IUPAC4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide
SMILESCc1ccc(C(=O)NNC(=O)Cc2cccs2)cc1
InChIInChI=1S/C14H14N2O2S/c1-10-4-6-11(7-5-10)14(18)16-15-13(17)9-12-3-2-8-19-12/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyZLSQBDQGUAOVJB-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.06
Rot. Bonds3

About 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide

4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide (PubChem CID 2672376) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide.

Molecular Properties

Compound Name4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide
PubChem CID2672376
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC Name4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide
SMILESCc1ccc(C(=O)NNC(=O)Cc2cccs2)cc1
InChIInChI=1S/C14H14N2O2S/c1-10-4-6-11(7-5-10)14(18)16-15-13(17)9-12-3-2-8-19-12/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyZLSQBDQGUAOVJB-UHFFFAOYSA-N
XLogP2.06
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-Methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide
CID 4961736
4-Cyano-3-methyl-5-phenylthiophene-2-carbohydrazide
CID 838334
N'1-acetyl-3-(methylthio)-6,7-dihydrobenzo[c]thiophene-1-carbohydrazide
CID 2820129
N-[(E)-[(E)-2-methyl-3-phenylprop-2-enylidene]amino]thiophene-2-carboxamide
CID 6880299
N'-benzoylthiophene-2-carbohydrazide
CID 790437
3-Phenylthiophene-2-carboxamide
CID 22374565
3-Methylthiophene-2-carbohydrazide
CID 2760084
1-Benzothiophene-2-carbohydrazide
CID 519437
4-Bromo-benzoic acid N'-(thiophene-2-carbonyl)-hydrazide
CID 766481
4-Cyano-3-methyl-5-(4-methylphenyl)-2-thiophenecarbohydrazide
CID 793865
2-Bromo-benzoic acid N'-(thiophene-2-carbonyl)-hydrazide
CID 809174
N'-[(E)-3-thiophen-2-ylprop-2-enoyl]benzohydrazide
CID 922960

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide?
The IUPAC name of 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide (CID 2672376) is 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide.
What is the SMILES notation for 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide?
The canonical SMILES for 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide is Cc1ccc(C(=O)NNC(=O)Cc2cccs2)cc1.
What is the InChIKey of 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide?
The InChIKey is ZLSQBDQGUAOVJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-10-4-6-11(7-5-10)14(18)16-15-13(17)9-12-3-2-8-19-12/h2-8H,9H2,1H3,(H,15,17)(H,16,18).
What are the key properties of 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide?
4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide has a molecular weight of 274.35 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N'-(2-thiophen-2-ylacetyl)benzohydrazide is sourced from PubChem (CID 2672376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).