2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide

C18H16N2O4 — CID 9103625

IUPAC2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCc1ccc2c(CC(=O)NNC(=O)c3ccccc3O)coc2c1
InChIInChI=1S/C18H16N2O4/c1-11-6-7-13-12(10-24-16(13)8-11)9-17(22)19-20-18(23)14-4-2-3-5-15(14)21/h2-8,10,21H,9H2,1H3,(H,19,22)(H,20,23)
InChIKeyRUMTWZFMFKKXDQ-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.45
Rot. Bonds3

About 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide

2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide (PubChem CID 9103625) has the molecular formula C18H16N2O4 and a molecular weight of 324.34 g/mol. Its IUPAC name is 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide.

Molecular Properties

Compound Name2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
PubChem CID9103625
Molecular FormulaC18H16N2O4
Molecular Weight324.34 g/mol
Exact Mass324.11
IUPAC Name2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCc1ccc2c(CC(=O)NNC(=O)c3ccccc3O)coc2c1
InChIInChI=1S/C18H16N2O4/c1-11-6-7-13-12(10-24-16(13)8-11)9-17(22)19-20-18(23)14-4-2-3-5-15(14)21/h2-8,10,21H,9H2,1H3,(H,19,22)(H,20,23)
InChIKeyRUMTWZFMFKKXDQ-UHFFFAOYSA-N
XLogP2.45
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.45
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-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide?
The IUPAC name of 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide (CID 9103625) is 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide.
What is the SMILES notation for 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide?
The canonical SMILES for 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide is Cc1ccc2c(CC(=O)NNC(=O)c3ccccc3O)coc2c1.
What is the InChIKey of 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide?
The InChIKey is RUMTWZFMFKKXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O4/c1-11-6-7-13-12(10-24-16(13)8-11)9-17(22)19-20-18(23)14-4-2-3-5-15(14)21/h2-8,10,21H,9H2,1H3,(H,19,22)(H,20,23).
What are the key properties of 2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide?
2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide has a molecular weight of 324.34 g/mol, XLogP of 2.45, 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-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide is sourced from PubChem (CID 9103625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).