2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide

C13H12N2O3S — CID 24980316

IUPAC2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide
SMILESO=C(Cc1ccsc1)NNC(=O)c1ccccc1O
InChIInChI=1S/C13H12N2O3S/c16-11-4-2-1-3-10(11)13(18)15-14-12(17)7-9-5-6-19-8-9/h1-6,8,16H,7H2,(H,14,17)(H,15,18)
InChIKeyAPSIJYXVHNDPJR-UHFFFAOYSA-N
MW276.32 g/mol
LogP1.46
Rot. Bonds3

About 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide

2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide (PubChem CID 24980316) has the molecular formula C13H12N2O3S and a molecular weight of 276.32 g/mol. Its IUPAC name is 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide.

Molecular Properties

Compound Name2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide
PubChem CID24980316
Molecular FormulaC13H12N2O3S
Molecular Weight276.32 g/mol
Exact Mass276.06
IUPAC Name2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide
SMILESO=C(Cc1ccsc1)NNC(=O)c1ccccc1O
InChIInChI=1S/C13H12N2O3S/c16-11-4-2-1-3-10(11)13(18)15-14-12(17)7-9-5-6-19-8-9/h1-6,8,16H,7H2,(H,14,17)(H,15,18)
InChIKeyAPSIJYXVHNDPJR-UHFFFAOYSA-N
XLogP1.46
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.32
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide?
The IUPAC name of 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide (CID 24980316) is 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide.
What is the SMILES notation for 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide?
The canonical SMILES for 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide is O=C(Cc1ccsc1)NNC(=O)c1ccccc1O.
What is the InChIKey of 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide?
The InChIKey is APSIJYXVHNDPJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O3S/c16-11-4-2-1-3-10(11)13(18)15-14-12(17)7-9-5-6-19-8-9/h1-6,8,16H,7H2,(H,14,17)(H,15,18).
What are the key properties of 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide?
2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide has a molecular weight of 276.32 g/mol, XLogP of 1.46, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N'-(2-thiophen-3-ylacetyl)benzohydrazide is sourced from PubChem (CID 24980316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).