N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide

C17H18N2O4 — CID 732287

IUPACN'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)c2ccccc2C)cc1
InChIInChI=1S/C17H18N2O4/c1-12-5-3-4-6-15(12)17(21)19-18-16(20)11-23-14-9-7-13(22-2)8-10-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyHVXBANRVSHCZKI-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.84
Rot. Bonds5

About N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide

N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide (PubChem CID 732287) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide
PubChem CID732287
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC NameN'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide
SMILESCOc1ccc(OCC(=O)NNC(=O)c2ccccc2C)cc1
InChIInChI=1S/C17H18N2O4/c1-12-5-3-4-6-15(12)17(21)19-18-16(20)11-23-14-9-7-13(22-2)8-10-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyHVXBANRVSHCZKI-UHFFFAOYSA-N
XLogP1.84
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.84
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-methoxyphenoxy)acetyl]-2-(2-methylphenyl)acetohydrazide
CID 26163562
N'-[2-(4-methoxyphenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929179
N'-[2-(4-methoxyphenoxy)acetyl]-2-methylfuran-3-carbohydrazide
CID 922681
N'-[2-(2,3-dihydro-1H-inden-5-yloxy)acetyl]-2-methylbenzohydrazide
CID 9220922
N'-[2-(4-methoxyphenoxy)acetyl]-2-pentoxybenzohydrazide
CID 4946756
2-(4-tert-butylphenoxy)-N-[[(2-methylbenzoyl)amino]carbamothioyl]acetamide
CID 5161899
1-N',4-N'-bis(2-methylbenzoyl)butanedihydrazide
CID 4630875
2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
CID 793888
methyl 4-[2-[2-(2-chlorobenzoyl)hydrazinyl]-2-oxoethoxy]benzoate
CID 1037884
2-methoxy-N-[[[2-(4-methoxyphenoxy)acetyl]amino]carbamothioyl]benzamide
CID 4980684
N-[3-[2-(4-methoxyphenoxy)ethylamino]-3-oxopropyl]-2-methylbenzamide
CID 8935922
2-(4-methoxyphenoxy)-N'-[2-(2,4,6-trimethylphenoxy)acetyl]acetohydrazide
CID 2479123

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide?
The IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide (CID 732287) is N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide.
What is the SMILES notation for N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide?
The canonical SMILES for N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide is COc1ccc(OCC(=O)NNC(=O)c2ccccc2C)cc1.
What is the InChIKey of N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide?
The InChIKey is HVXBANRVSHCZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-12-5-3-4-6-15(12)17(21)19-18-16(20)11-23-14-9-7-13(22-2)8-10-14/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide?
N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide has a molecular weight of 314.34 g/mol, XLogP of 1.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methoxyphenoxy)acetyl]-2-methylbenzohydrazide is sourced from PubChem (CID 732287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).