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

C18H19FN2O5 — CID 7809026

IUPAC2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2ccccc2F)cc1OC
InChIInChI=1S/C18H19FN2O5/c1-24-15-8-7-12(9-16(15)25-2)10-17(22)20-21-18(23)11-26-14-6-4-3-5-13(14)19/h3-9H,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHPODERWZSHRCIF-UHFFFAOYSA-N
MW362.36 g/mol
LogP1.61
Rot. Bonds7

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

2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide (PubChem CID 7809026) has the molecular formula C18H19FN2O5 and a molecular weight of 362.36 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
PubChem CID7809026
Molecular FormulaC18H19FN2O5
Molecular Weight362.36 g/mol
Exact Mass362.13
IUPAC Name2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)COc2ccccc2F)cc1OC
InChIInChI=1S/C18H19FN2O5/c1-24-15-8-7-12(9-16(15)25-2)10-17(22)20-21-18(23)11-26-14-6-4-3-5-13(14)19/h3-9H,10-11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyHPODERWZSHRCIF-UHFFFAOYSA-N
XLogP1.61
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.36
LogP ≤ 51.61
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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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide (CID 7809026) is 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide is COc1ccc(CC(=O)NNC(=O)COc2ccccc2F)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
The InChIKey is HPODERWZSHRCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O5/c1-24-15-8-7-12(9-16(15)25-2)10-17(22)20-21-18(23)11-26-14-6-4-3-5-13(14)19/h3-9H,10-11H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of 2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide?
2-(3,4-dimethoxyphenyl)-N'-[2-(2-fluorophenoxy)acetyl]acetohydrazide has a molecular weight of 362.36 g/mol, XLogP of 1.61, 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-(2-fluorophenoxy)acetyl]acetohydrazide is sourced from PubChem (CID 7809026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).