N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide

C17H19N3O3 — CID 54793228

IUPACN-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide
SMILESCc1cc(C)cc(NC(=O)COc2ccc(C(=O)NN)cc2)c1
InChIInChI=1S/C17H19N3O3/c1-11-7-12(2)9-14(8-11)19-16(21)10-23-15-5-3-13(4-6-15)17(22)20-18/h3-9H,10,18H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFJOXKIUOMSXMEG-UHFFFAOYSA-N
MW313.36 g/mol
LogP1.92
Rot. Bonds5

About N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide

N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide (PubChem CID 54793228) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide
PubChem CID54793228
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide
SMILESCc1cc(C)cc(NC(=O)COc2ccc(C(=O)NN)cc2)c1
InChIInChI=1S/C17H19N3O3/c1-11-7-12(2)9-14(8-11)19-16(21)10-23-15-5-3-13(4-6-15)17(22)20-18/h3-9H,10,18H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyFJOXKIUOMSXMEG-UHFFFAOYSA-N
XLogP1.92
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 51.92
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

N-(2,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide
CID 54793156
2-(6-bromonaphthalen-2-yl)oxy-N-(3,5-dimethylphenyl)acetamide
CID 7786804
N-[4-[[2-(3,5-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 17235341
N-(3,5-dimethylphenyl)-2-(7-methoxynaphthalen-2-yl)oxyacetamide
CID 7652726
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-(2,5-dimethylpyrrol-1-yl)-4-[2-(3-methylanilino)-2-oxoethoxy]benzamide
CID 9252560
methyl 2-[4-[[2-(3,5-dimethylphenoxy)acetyl]amino]phenoxy]acetate
CID 2975656
N-(3,5-dichlorophenyl)-2-[4-(3,5-dimethylphenoxy)phenoxy]acetamide
CID 18870439
methyl 2-[[4-[[2-(3,5-dimethylphenoxy)acetyl]amino]benzoyl]amino]acetate
CID 9049177
4-[[2-(4-methoxyphenoxy)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 2710766
5-[[2-(3,5-dimethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
CID 17359281
4-[2-oxo-2-(2,4,6-trimethylanilino)ethoxy]benzamide
CID 7931575

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide?
The IUPAC name of N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide (CID 54793228) is N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide is Cc1cc(C)cc(NC(=O)COc2ccc(C(=O)NN)cc2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide?
The InChIKey is FJOXKIUOMSXMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-11-7-12(2)9-14(8-11)19-16(21)10-23-15-5-3-13(4-6-15)17(22)20-18/h3-9H,10,18H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide?
N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide has a molecular weight of 313.36 g/mol, XLogP of 1.92, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-[4-(hydrazinecarbonyl)phenoxy]acetamide is sourced from PubChem (CID 54793228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).