2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide

C19H22N2O5 — CID 7808998

IUPAC2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2cccc(C)c2)cc1OC
InChIInChI=1S/C19H22N2O5/c1-13-5-4-6-15(9-13)26-12-19(23)21-20-18(22)11-14-7-8-16(24-2)17(10-14)25-3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyGZZQKZZOTXZORL-UHFFFAOYSA-N
MW358.39 g/mol
LogP1.78
Rot. Bonds7

About 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide

2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide (PubChem CID 7808998) has the molecular formula C19H22N2O5 and a molecular weight of 358.39 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
PubChem CID7808998
Molecular FormulaC19H22N2O5
Molecular Weight358.39 g/mol
Exact Mass358.15
IUPAC Name2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2cccc(C)c2)cc1OC
InChIInChI=1S/C19H22N2O5/c1-13-5-4-6-15(9-13)26-12-19(23)21-20-18(22)11-14-7-8-16(24-2)17(10-14)25-3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyGZZQKZZOTXZORL-UHFFFAOYSA-N
XLogP1.78
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.39
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethoxyphenyl)-N-[3-(3-methylphenoxy)propyl]acetamide
CID 24533354
[2-[2-(3-methylphenoxy)ethylamino]-2-oxoethyl] 2-(3,4-dimethoxyphenyl)acetate
CID 29349192
methyl 3-[2-[2-(3-methylphenoxy)acetyl]hydrazinyl]-3-oxopropanoate
CID 28638195
3-(2-methoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]propanehydrazide
CID 26901623
3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
CID 24538794
N-(4,5-dimethoxy-2-methylphenyl)-2-(3-methylphenoxy)acetamide
CID 26209437
N'-acetyl-2-(3,4-dimethoxyphenyl)acetohydrazide
CID 799227
2-ethoxy-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 17140856
N'-[2-(2-benzylphenoxy)acetyl]-2-(3-methylphenoxy)acetohydrazide
CID 7943215
N-methyl-2-(3-methylphenoxy)acetamide
CID 15943355
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
N'-[2-(3,5-dimethylphenoxy)acetyl]-2-(4-methoxyphenyl)acetohydrazide
CID 909252

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide (CID 7808998) is 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide is COc1ccc(CC(=O)NNC(=O)COc2cccc(C)c2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide?
The InChIKey is GZZQKZZOTXZORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5/c1-13-5-4-6-15(9-13)26-12-19(23)21-20-18(22)11-14-7-8-16(24-2)17(10-14)25-3/h4-10H,11-12H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide?
2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide has a molecular weight of 358.39 g/mol, XLogP of 1.78, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide is sourced from PubChem (CID 7808998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).