N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide

C25H26N2O5 — CID 17073439

IUPACN'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide
SMILESCCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C25H26N2O5/c1-3-23(32-22-11-9-19(10-12-22)18-7-5-4-6-8-18)25(29)27-26-24(28)17-31-21-15-13-20(30-2)14-16-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyWXQMHDYCNNDJQS-UHFFFAOYSA-N
MW434.49 g/mol
LogP3.75
Rot. Bonds9

About N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide

N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide (PubChem CID 17073439) has the molecular formula C25H26N2O5 and a molecular weight of 434.49 g/mol. Its IUPAC name is N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide.

Molecular Properties

Compound NameN'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide
PubChem CID17073439
Molecular FormulaC25H26N2O5
Molecular Weight434.49 g/mol
Exact Mass434.18
IUPAC NameN'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide
SMILESCCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc(OC)cc1
InChIInChI=1S/C25H26N2O5/c1-3-23(32-22-11-9-19(10-12-22)18-7-5-4-6-8-18)25(29)27-26-24(28)17-31-21-15-13-20(30-2)14-16-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyWXQMHDYCNNDJQS-UHFFFAOYSA-N
XLogP3.75
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.49
LogP ≤ 53.75
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-(4-methylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]butanehydrazide
CID 4950205
2-phenoxy-N'-[2-(4-propan-2-ylphenoxy)acetyl]butanehydrazide
CID 4929692
N'-butanoyl-2-(4-phenylphenoxy)butanehydrazide
CID 17073544
2-(4-phenylphenoxy)-N'-(3-phenylpropanoyl)butanehydrazide
CID 17073452
4-phenyl-N'-[2-(4-phenylphenoxy)butanoyl]benzohydrazide
CID 17073450
N'-[2-(4-bromo-2-chlorophenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide
CID 17073519
2-(2-methoxyphenoxy)-N'-[2-(4-phenylphenoxy)acetyl]propanehydrazide
CID 4943458
3-methyl-N'-(2-phenoxybutanoyl)butanehydrazide
CID 24543011
2-chloro-N'-[2-(4-phenylphenoxy)butanoyl]benzohydrazide
CID 17073460
N-[4-(2-methoxyethoxy)phenyl]-2-(4-phenylphenoxy)butanamide
CID 17073434
N'-acetyl-2-(4-phenylphenoxy)acetohydrazide
CID 3274977
N-[1-(4-methoxyphenoxy)propan-2-yl]-2-phenoxybutanamide
CID 132652458

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide?
The IUPAC name of N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide (CID 17073439) is N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide.
What is the SMILES notation for N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide?
The canonical SMILES for N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide is CCC(Oc1ccc(-c2ccccc2)cc1)C(=O)NNC(=O)COc1ccc(OC)cc1.
What is the InChIKey of N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide?
The InChIKey is WXQMHDYCNNDJQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O5/c1-3-23(32-22-11-9-19(10-12-22)18-7-5-4-6-8-18)25(29)27-26-24(28)17-31-21-15-13-20(30-2)14-16-21/h4-16,23H,3,17H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide?
N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide has a molecular weight of 434.49 g/mol, XLogP of 3.75, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methoxyphenoxy)acetyl]-2-(4-phenylphenoxy)butanehydrazide is sourced from PubChem (CID 17073439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).