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

C19H18N2O4 — CID 2492500

IUPACN'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide
SMILESCOc1ccc2c(CC(=O)NNC(=O)c3ccc(C)cc3)coc2c1
InChIInChI=1S/C19H18N2O4/c1-12-3-5-13(6-4-12)19(23)21-20-18(22)9-14-11-25-17-10-15(24-2)7-8-16(14)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyORSRYASEUGASOJ-UHFFFAOYSA-N
MW338.36 g/mol
LogP2.75
Rot. Bonds4

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

N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide (PubChem CID 2492500) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide.

Molecular Properties

Compound NameN'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide
PubChem CID2492500
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide
SMILESCOc1ccc2c(CC(=O)NNC(=O)c3ccc(C)cc3)coc2c1
InChIInChI=1S/C19H18N2O4/c1-12-3-5-13(6-4-12)19(23)21-20-18(22)9-14-11-25-17-10-15(24-2)7-8-16(14)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyORSRYASEUGASOJ-UHFFFAOYSA-N
XLogP2.75
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.75
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

4-methoxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 18872308
4-hydroxy-N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]benzohydrazide
CID 8895546
2-(6-methoxy-1-benzofuran-3-yl)-N-(2-methoxyethyl)acetamide
CID 29290752
N'-[2-(5-ethyl-1-benzofuran-3-yl)acetyl]-4-methoxybenzohydrazide
CID 18872538
(2R)-2-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]propanamide
CID 92542869
N-benzyl-2-(6-methoxy-1-benzofuran-3-yl)acetamide
CID 2598100
3-methoxy-N'-[2-(6-methyl-1-benzofuran-3-yl)acetyl]-4-propan-2-yloxybenzohydrazide
CID 18270509
2-(6-methoxy-1-benzofuran-3-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 27742710
N'-[2-(3,5-dimethylpyrazol-1-yl)acetyl]-2-(6-methoxy-1-benzofuran-3-yl)acetohydrazide
CID 34988498
N-[2-(4-methoxyphenyl)ethyl]-2-(6-methyl-1-benzofuran-3-yl)acetamide
CID 2107129
N'-[2-[4-(4-cyanophenyl)phenoxy]acetyl]-2-(6-methoxy-1-benzofuran-3-yl)acetohydrazide
CID 24636209
4-[[2-(6-methoxy-1-benzofuran-3-yl)acetyl]amino]-N-(2,2,2-trifluoroethyl)benzamide
CID 46803550

Frequently Asked Questions

What is the IUPAC name of N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide?
The IUPAC name of N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide (CID 2492500) is N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide.
What is the SMILES notation for N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide?
The canonical SMILES for N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide is COc1ccc2c(CC(=O)NNC(=O)c3ccc(C)cc3)coc2c1.
What is the InChIKey of N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide?
The InChIKey is ORSRYASEUGASOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-12-3-5-13(6-4-12)19(23)21-20-18(22)9-14-11-25-17-10-15(24-2)7-8-16(14)17/h3-8,10-11H,9H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide?
N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide has a molecular weight of 338.36 g/mol, XLogP of 2.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(6-methoxy-1-benzofuran-3-yl)acetyl]-4-methylbenzohydrazide is sourced from PubChem (CID 2492500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).