5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide

C19H18N2O4 — CID 8913378

IUPAC5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide
SMILESCOc1ccc2oc(C(=O)NNC(=O)c3ccc(C)cc3)c(C)c2c1
InChIInChI=1S/C19H18N2O4/c1-11-4-6-13(7-5-11)18(22)20-21-19(23)17-12(2)15-10-14(24-3)8-9-16(15)25-17/h4-10H,1-3H3,(H,20,22)(H,21,23)
InChIKeyWVDFWNDZTQSKQQ-UHFFFAOYSA-N
MW338.36 g/mol
LogP3.13
Rot. Bonds3

About 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide

5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide (PubChem CID 8913378) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide.

Molecular Properties

Compound Name5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide
PubChem CID8913378
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide
SMILESCOc1ccc2oc(C(=O)NNC(=O)c3ccc(C)cc3)c(C)c2c1
InChIInChI=1S/C19H18N2O4/c1-11-4-6-13(7-5-11)18(22)20-21-19(23)17-12(2)15-10-14(24-3)8-9-16(15)25-17/h4-10H,1-3H3,(H,20,22)(H,21,23)
InChIKeyWVDFWNDZTQSKQQ-UHFFFAOYSA-N
XLogP3.13
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 53.13
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'-(4-fluorobenzoyl)-5-methoxy-3-methyl-1-benzofuran-2-carbohydrazide
CID 7732767
N'-benzoyl-5-methoxy-3-methyl-1-benzofuran-2-carbohydrazide
CID 51155700
5-methoxy-3-methyl-N'-[2-(4-methylphenoxy)acetyl]-1-benzofuran-2-carbohydrazide
CID 8873473
N'-(4-ethoxy-3-methoxybenzoyl)-5-methoxy-3-methyl-1-benzofuran-2-carbohydrazide
CID 25469436
5-methoxy-3-methyl-N-[4-(methylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
CID 8700218
5-methoxy-3-methyl-N'-phenyl-1-benzofuran-2-carbohydrazide
CID 78774610
3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide
CID 27608073
N'-(5-bromothiophene-2-carbonyl)-5-methoxy-3-methyl-1-benzofuran-2-carbohydrazide
CID 9090843
N-(2-hydroxy-4-methylphenyl)-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 17473856
N-(3,5-dimethoxyphenyl)-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 7959819
1-cyclopentyl-3-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]thiourea
CID 9090114
N-(2,3-dimethylphenyl)-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 2679062

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide?
The IUPAC name of 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide (CID 8913378) is 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide.
What is the SMILES notation for 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide?
The canonical SMILES for 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide is COc1ccc2oc(C(=O)NNC(=O)c3ccc(C)cc3)c(C)c2c1.
What is the InChIKey of 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide?
The InChIKey is WVDFWNDZTQSKQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-11-4-6-13(7-5-11)18(22)20-21-19(23)17-12(2)15-10-14(24-3)8-9-16(15)25-17/h4-10H,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide?
5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide has a molecular weight of 338.36 g/mol, XLogP of 3.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-methyl-N'-(4-methylbenzoyl)-1-benzofuran-2-carbohydrazide is sourced from PubChem (CID 8913378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).