2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide

C18H15FN2O4 — CID 2521033

IUPAC2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCOc1ccc2c(CC(=O)NNC(=O)c3ccccc3F)coc2c1
InChIInChI=1S/C18H15FN2O4/c1-24-12-6-7-13-11(10-25-16(13)9-12)8-17(22)20-21-18(23)14-4-2-3-5-15(14)19/h2-7,9-10H,8H2,1H3,(H,20,22)(H,21,23)
InChIKeyBVIFZIIACCFDHC-UHFFFAOYSA-N
MW342.33 g/mol
LogP2.58
Rot. Bonds4

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

2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide (PubChem CID 2521033) has the molecular formula C18H15FN2O4 and a molecular weight of 342.33 g/mol. Its IUPAC name is 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide.

Molecular Properties

Compound Name2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
PubChem CID2521033
Molecular FormulaC18H15FN2O4
Molecular Weight342.33 g/mol
Exact Mass342.10
IUPAC Name2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCOc1ccc2c(CC(=O)NNC(=O)c3ccccc3F)coc2c1
InChIInChI=1S/C18H15FN2O4/c1-24-12-6-7-13-11(10-25-16(13)9-12)8-17(22)20-21-18(23)14-4-2-3-5-15(14)19/h2-7,9-10H,8H2,1H3,(H,20,22)(H,21,23)
InChIKeyBVIFZIIACCFDHC-UHFFFAOYSA-N
XLogP2.58
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.33
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4,6-dimethyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 2982934
N'-[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 18079669
N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 2576871
2-(6-methoxy-1-benzofuran-3-yl)-N'-[2-(4-methoxyphenoxy)acetyl]acetohydrazide
CID 2670545
2-hydroxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 9103625
N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide
CID 2492500
4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 4801202
4-hydroxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 8895546
N'-[2-(5,6-dimethyl-1-benzofuran-3-yl)acetyl]-2-fluorobenzohydrazide
CID 16391190
4-Methoxybenzofuran-5-carboxamide
CID 122195902
6-Methoxybenzofuran-5-carboxamide
CID 122195903
N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]thiophene-2-carbohydrazide
CID 16248691

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The IUPAC name of 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide (CID 2521033) is 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide.
What is the SMILES notation for 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The canonical SMILES for 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide is COc1ccc2c(CC(=O)NNC(=O)c3ccccc3F)coc2c1.
What is the InChIKey of 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The InChIKey is BVIFZIIACCFDHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O4/c1-24-12-6-7-13-11(10-25-16(13)9-12)8-17(22)20-21-18(23)14-4-2-3-5-15(14)19/h2-7,9-10H,8H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide has a molecular weight of 342.33 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide is sourced from PubChem (CID 2521033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).