N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide

C19H22N2O4 — CID 4119313

IUPACN'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide
SMILESCOC(C(=O)NNC(=O)COc1ccc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H22N2O4/c1-13-9-10-16(14(2)11-13)25-12-17(22)20-21-19(23)18(24-3)15-7-5-4-6-8-15/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDOPSWMBOXIUHOX-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.22
Rot. Bonds6

About N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide

N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide (PubChem CID 4119313) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide.

Molecular Properties

Compound NameN'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide
PubChem CID4119313
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide
SMILESCOC(C(=O)NNC(=O)COc1ccc(C)cc1C)c1ccccc1
InChIInChI=1S/C19H22N2O4/c1-13-9-10-16(14(2)11-13)25-12-17(22)20-21-19(23)18(24-3)15-7-5-4-6-8-15/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyDOPSWMBOXIUHOX-UHFFFAOYSA-N
XLogP2.22
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 52.22
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

(2R)-N'-[2-(2-bromo-4-methylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide
CID 40572245
2-methoxy-N'-[2-(2-methylphenoxy)acetyl]-2-phenylacetohydrazide
CID 4166134
2-(2,4-dimethylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 4500297
N'-[2-(2,5-dimethylphenoxy)acetyl]-3,3-diphenylpropanehydrazide
CID 7943424
N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 909269
2-(2,4-dimethylphenoxy)-N-(3,3-diphenylpropyl)acetamide
CID 39939589
2-(2,4-dimethylphenoxy)-N-(1-phenylpropyl)acetamide
CID 17328158
5-[2-[2-(2,4-dimethylphenoxy)acetyl]hydrazinyl]-5-oxopentanoic acid
CID 4949715
N'-[2-(2,5-dimethylphenoxy)acetyl]-2-phenoxypropanehydrazide
CID 3473295
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(3-methylphenoxy)butanehydrazide
CID 4928664
(2R)-2-methoxy-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide
CID 883174
2-(2,4-dimethylphenoxy)-N-methylacetamide
CID 965410

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide?
The IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide (CID 4119313) is N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide.
What is the SMILES notation for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide?
The canonical SMILES for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide is COC(C(=O)NNC(=O)COc1ccc(C)cc1C)c1ccccc1.
What is the InChIKey of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide?
The InChIKey is DOPSWMBOXIUHOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13-9-10-16(14(2)11-13)25-12-17(22)20-21-19(23)18(24-3)15-7-5-4-6-8-15/h4-11,18H,12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide?
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-methoxy-2-phenylacetohydrazide is sourced from PubChem (CID 4119313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).