4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide

C17H18N2O3 — CID 26163580

IUPAC4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O3/c1-12-5-3-4-6-14(12)11-16(20)18-19-17(21)13-7-9-15(22-2)10-8-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyNRQSLAGKQJBYFF-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.01
Rot. Bonds4

About 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide

4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide (PubChem CID 26163580) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
PubChem CID26163580
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)Cc2ccccc2C)cc1
InChIInChI=1S/C17H18N2O3/c1-12-5-3-4-6-14(12)11-16(20)18-19-17(21)13-7-9-15(22-2)10-8-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyNRQSLAGKQJBYFF-UHFFFAOYSA-N
XLogP2.01
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-methoxyphenoxy)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 26163562
4-hexoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
CID 26163669
4-ethoxy-3-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide
CID 30860668
1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
2-methyl-N-[4-[[[2-(2-methylphenyl)acetyl]amino]carbamoyl]phenyl]propanamide
CID 26163659
N-(4-methoxyphenyl)-2-(2-methylphenyl)acetamide
CID 6467093
3-methoxy-N'-[2-(2-methylphenyl)acetyl]-4-propan-2-yloxybenzohydrazide
CID 8621917
4-tert-butyl-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 795496
1-N',9-N'-bis(4-methoxybenzoyl)nonanedihydrazide
CID 3123941
[2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-[(4-methoxybenzoyl)amino]acetate
CID 9345718
N'-[2-(2-methylphenyl)acetyl]pyridine-3-carbohydrazide
CID 35152193
4-bromo-N'-[2-(2,5-dimethoxyphenyl)acetyl]benzohydrazide
CID 78805092

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The IUPAC name of 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide (CID 26163580) is 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide.
What is the SMILES notation for 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The canonical SMILES for 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide is COc1ccc(C(=O)NNC(=O)Cc2ccccc2C)cc1.
What is the InChIKey of 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
The InChIKey is NRQSLAGKQJBYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c1-12-5-3-4-6-14(12)11-16(20)18-19-17(21)13-7-9-15(22-2)10-8-13/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide?
4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide has a molecular weight of 298.34 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N'-[2-(2-methylphenyl)acetyl]benzohydrazide is sourced from PubChem (CID 26163580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).