N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide

C19H22N2O4 — CID 909252

IUPACN'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-13-8-14(2)10-17(9-13)25-12-19(23)21-20-18(22)11-15-4-6-16(24-3)7-5-15/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyHGKGVZVJZPOKMX-UHFFFAOYSA-N
MW342.40 g/mol
LogP2.08
Rot. Bonds6

About N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide

N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide (PubChem CID 909252) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide.

Molecular Properties

Compound NameN'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide
PubChem CID909252
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC NameN'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1
InChIInChI=1S/C19H22N2O4/c1-13-8-14(2)10-17(9-13)25-12-19(23)21-20-18(22)11-15-4-6-16(24-3)7-5-15/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyHGKGVZVJZPOKMX-UHFFFAOYSA-N
XLogP2.08
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 ≤ 52.08
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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Frequently Asked Questions

What is the IUPAC name of N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide?
The IUPAC name of N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide (CID 909252) is N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide.
What is the SMILES notation for N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide?
The canonical SMILES for N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide is COc1ccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1.
What is the InChIKey of N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide?
The InChIKey is HGKGVZVJZPOKMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-13-8-14(2)10-17(9-13)25-12-19(23)21-20-18(22)11-15-4-6-16(24-3)7-5-15/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide?
N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide has a molecular weight of 342.40 g/mol, XLogP of 2.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide is sourced from PubChem (CID 909252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).