2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide

C16H17N3O3 — CID 54793411

IUPAC2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2C(=O)NN)cc1
InChIInChI=1S/C16H17N3O3/c1-11-6-8-12(9-7-11)18-15(20)10-22-14-5-3-2-4-13(14)16(21)19-17/h2-9H,10,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyHDVGUZNUZYCNJO-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.62
Rot. Bonds5

About 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide

2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide (PubChem CID 54793411) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide
PubChem CID54793411
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)COc2ccccc2C(=O)NN)cc1
InChIInChI=1S/C16H17N3O3/c1-11-6-8-12(9-7-11)18-15(20)10-22-14-5-3-2-4-13(14)16(21)19-17/h2-9H,10,17H2,1H3,(H,18,20)(H,19,21)
InChIKeyHDVGUZNUZYCNJO-UHFFFAOYSA-N
XLogP1.62
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(E)-N-hydroxy-C-methylcarbonimidoyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 24694563
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-[2-(3,5-dimethylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980967
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 2709122
2-[2-(4-bromoanilino)-2-oxoethoxy]-N-(2,5-dimethylphenyl)benzamide
CID 112759231
2-[2-(4-bromoanilino)-2-oxoethoxy]-N-[2-(4-bromoanilino)-2-oxoethyl]benzamide
CID 46937197
2-[2-(4-fluoroanilino)-2-oxoethoxy]benzamide
CID 7283884
2-(2,3-dichlorophenoxy)-N-(4-methylphenyl)acetamide
CID 2602907
2-butoxy-N-(4-methylphenyl)benzamide
CID 4940933
2-[2-(anilinomethyl)phenoxy]-N-(4-methylphenyl)acetamide
CID 66538833
2-chloro-N-[4-[[2-(2-methylphenoxy)acetyl]amino]phenyl]benzamide
CID 35767797
2-[2-[(2S)-butan-2-yl]phenoxy]-N-(4-methylphenyl)acetamide
CID 833563

Frequently Asked Questions

What is the IUPAC name of 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide (CID 54793411) is 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)COc2ccccc2C(=O)NN)cc1.
What is the InChIKey of 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide?
The InChIKey is HDVGUZNUZYCNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-11-6-8-12(9-7-11)18-15(20)10-22-14-5-3-2-4-13(14)16(21)19-17/h2-9H,10,17H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide?
2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide has a molecular weight of 299.33 g/mol, XLogP of 1.62, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydrazinecarbonyl)phenoxy]-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 54793411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).