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

C19H18N2O5 — CID 4801202

IUPAC4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2coc3cc(OC)ccc23)cc1
InChIInChI=1S/C19H18N2O5/c1-24-14-5-3-12(4-6-14)19(23)21-20-18(22)9-13-11-26-17-10-15(25-2)7-8-16(13)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyFNGHQOUGZWRYQI-UHFFFAOYSA-N
MW354.36 g/mol
LogP2.45
Rot. Bonds5

About 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide

4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide (PubChem CID 4801202) has the molecular formula C19H18N2O5 and a molecular weight of 354.36 g/mol. Its IUPAC name is 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
PubChem CID4801202
Molecular FormulaC19H18N2O5
Molecular Weight354.36 g/mol
Exact Mass354.12
IUPAC Name4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2coc3cc(OC)ccc23)cc1
InChIInChI=1S/C19H18N2O5/c1-24-14-5-3-12(4-6-14)19(23)21-20-18(22)9-13-11-26-17-10-15(25-2)7-8-16(13)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyFNGHQOUGZWRYQI-UHFFFAOYSA-N
XLogP2.45
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The IUPAC name of 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide (CID 4801202) is 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide.
What is the SMILES notation for 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The canonical SMILES for 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide is COc1ccc(C(=O)NNC(=O)Cc2coc3cc(OC)ccc23)cc1.
What is the InChIKey of 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
The InChIKey is FNGHQOUGZWRYQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O5/c1-24-14-5-3-12(4-6-14)19(23)21-20-18(22)9-13-11-26-17-10-15(25-2)7-8-16(13)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide?
4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide has a molecular weight of 354.36 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide is sourced from PubChem (CID 4801202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).