N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide

C17H19N3O2 — CID 155375566

IUPACN-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(CC(=O)NN)cc2)cc1
InChIInChI=1S/C17H19N3O2/c1-12-2-4-13(5-3-12)10-16(21)19-15-8-6-14(7-9-15)11-17(22)20-18/h2-9H,10-11,18H2,1H3,(H,19,21)(H,20,22)
InChIKeyYHNNGIOCFBRYNL-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.71
Rot. Bonds5

About N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide

N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide (PubChem CID 155375566) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide
PubChem CID155375566
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide
SMILESCc1ccc(CC(=O)Nc2ccc(CC(=O)NN)cc2)cc1
InChIInChI=1S/C17H19N3O2/c1-12-2-4-13(5-3-12)10-16(21)19-15-8-6-14(7-9-15)11-17(22)20-18/h2-9H,10-11,18H2,1H3,(H,19,21)(H,20,22)
InChIKeyYHNNGIOCFBRYNL-UHFFFAOYSA-N
XLogP1.71
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-4-methylbenzamide
CID 100591745
2-(4-aminophenyl)-N-(4-methylphenyl)acetamide
CID 16782162
N-[4-(aminomethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 43152378
N-[4-(2-aminoethyl)phenyl]-2-(4-methylphenyl)acetamide
CID 62301337
N-(4-fluorophenyl)-2-(4-methylphenyl)acetamide
CID 889367
N-(4-methylphenyl)-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]acetamide
CID 110437429
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751
N'-[4-(aminomethyl)phenyl]-N-(4-methylphenyl)butanediamide
CID 143641353
2-[4-(difluoromethoxy)phenyl]-N-(4-methylphenyl)acetamide
CID 33142215
N-[4-(3-methylbutylamino)phenyl]-2-(4-methylphenyl)acetamide
CID 112985122
methyl 4-[4-[[2-(4-methylphenyl)acetyl]amino]anilino]benzoate
CID 112988583
2-(4-methoxyphenyl)-N-(4-methylphenyl)acetamide;methyl 2-(4-methoxyphenyl)acetate
CID 161099806

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide (CID 155375566) is N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide is Cc1ccc(CC(=O)Nc2ccc(CC(=O)NN)cc2)cc1.
What is the InChIKey of N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide?
The InChIKey is YHNNGIOCFBRYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-12-2-4-13(5-3-12)10-16(21)19-15-8-6-14(7-9-15)11-17(22)20-18/h2-9H,10-11,18H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide?
N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide has a molecular weight of 297.36 g/mol, XLogP of 1.71, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydrazinyl-2-oxoethyl)phenyl]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 155375566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).