N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide

C24H24N2O5 — CID 7941736

IUPACN'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide
SMILESCCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3cccc(OC)c3)cc2)cc1
InChIInChI=1S/C24H24N2O5/c1-3-30-20-11-13-21(14-12-20)31-16-17-7-9-18(10-8-17)23(27)25-26-24(28)19-5-4-6-22(15-19)29-2/h4-15H,3,16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyAKBABZFHDNILOX-UHFFFAOYSA-N
MW420.47 g/mol
LogP3.75
Rot. Bonds8

About N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide

N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide (PubChem CID 7941736) has the molecular formula C24H24N2O5 and a molecular weight of 420.47 g/mol. Its IUPAC name is N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide.

Molecular Properties

Compound NameN'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide
PubChem CID7941736
Molecular FormulaC24H24N2O5
Molecular Weight420.47 g/mol
Exact Mass420.17
IUPAC NameN'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide
SMILESCCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3cccc(OC)c3)cc2)cc1
InChIInChI=1S/C24H24N2O5/c1-3-30-20-11-13-21(14-12-20)31-16-17-7-9-18(10-8-17)23(27)25-26-24(28)19-5-4-6-22(15-19)29-2/h4-15H,3,16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyAKBABZFHDNILOX-UHFFFAOYSA-N
XLogP3.75
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.47
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-bromo-N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-5-methoxybenzohydrazide
CID 2461548
3-ethoxy-N-[[(4-methoxybenzoyl)amino]carbamothioyl]benzamide
CID 4957781
3-(difluoromethoxy)-N'-(4-ethoxybenzoyl)benzohydrazide
CID 26187379
N'-(4-ethoxybenzoyl)-3-methoxy-4-phenylmethoxybenzohydrazide
CID 9492724
N'-(4-aminobenzoyl)-3-methoxybenzohydrazide
CID 684303
N-[(1R)-1-(4-ethoxyphenyl)ethyl]-3-methoxybenzamide
CID 33300897
3-[(4-ethoxyphenoxy)methyl]benzohydrazide
CID 840785
N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-1-methylpyrazole-4-carbohydrazide
CID 9277379
3-ethoxy-N-[(4-phenylmethoxyphenyl)carbamothioyl]benzamide
CID 4957757
4-[(4-ethoxyphenoxy)methyl]-N-[(E)-1-(2-hydroxy-4-methoxyphenyl)ethylideneamino]benzamide
CID 135752121
N'-[2-(4-fluorophenoxy)acetyl]-3-methoxybenzohydrazide
CID 8880066
3-[(4-ethoxybenzoyl)amino]-N-(4-methoxyphenyl)benzamide
CID 1228510

Frequently Asked Questions

What is the IUPAC name of N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide?
The IUPAC name of N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide (CID 7941736) is N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide.
What is the SMILES notation for N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide?
The canonical SMILES for N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide is CCOc1ccc(OCc2ccc(C(=O)NNC(=O)c3cccc(OC)c3)cc2)cc1.
What is the InChIKey of N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide?
The InChIKey is AKBABZFHDNILOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O5/c1-3-30-20-11-13-21(14-12-20)31-16-17-7-9-18(10-8-17)23(27)25-26-24(28)19-5-4-6-22(15-19)29-2/h4-15H,3,16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide?
N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide has a molecular weight of 420.47 g/mol, XLogP of 3.75, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-[(4-ethoxyphenoxy)methyl]benzoyl]-3-methoxybenzohydrazide is sourced from PubChem (CID 7941736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).