N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide

C24H24N2O6 — CID 4952895

IUPACN'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
SMILESCOc1ccccc1OCC(=O)NNC(=O)c1ccc(OCCOc2ccccc2)cc1
InChIInChI=1S/C24H24N2O6/c1-29-21-9-5-6-10-22(21)32-17-23(27)25-26-24(28)18-11-13-20(14-12-18)31-16-15-30-19-7-3-2-4-8-19/h2-14H,15-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyNWDOSVUWONHORW-UHFFFAOYSA-N
MW436.46 g/mol
LogP2.99
Rot. Bonds10

About N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide

N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide (PubChem CID 4952895) has the molecular formula C24H24N2O6 and a molecular weight of 436.46 g/mol. Its IUPAC name is N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
PubChem CID4952895
Molecular FormulaC24H24N2O6
Molecular Weight436.46 g/mol
Exact Mass436.16
IUPAC NameN'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
SMILESCOc1ccccc1OCC(=O)NNC(=O)c1ccc(OCCOc2ccccc2)cc1
InChIInChI=1S/C24H24N2O6/c1-29-21-9-5-6-10-22(21)32-17-23(27)25-26-24(28)18-11-13-20(14-12-18)31-16-15-30-19-7-3-2-4-8-19/h2-14H,15-17H2,1H3,(H,25,27)(H,26,28)
InChIKeyNWDOSVUWONHORW-UHFFFAOYSA-N
XLogP2.99
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms32
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.46
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide?
The IUPAC name of N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide (CID 4952895) is N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide.
What is the SMILES notation for N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide?
The canonical SMILES for N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide is COc1ccccc1OCC(=O)NNC(=O)c1ccc(OCCOc2ccccc2)cc1.
What is the InChIKey of N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide?
The InChIKey is NWDOSVUWONHORW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O6/c1-29-21-9-5-6-10-22(21)32-17-23(27)25-26-24(28)18-11-13-20(14-12-18)31-16-15-30-19-7-3-2-4-8-19/h2-14H,15-17H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide?
N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide has a molecular weight of 436.46 g/mol, XLogP of 2.99, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide is sourced from PubChem (CID 4952895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).