N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide

C24H24N2O4 — CID 4938115

IUPACN'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1C
InChIInChI=1S/C24H24N2O4/c1-17-12-13-20(14-18(17)2)29-16-23(27)25-26-24(28)21-10-6-7-11-22(21)30-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyYJLASVSUXMWUDC-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.72
Rot. Bonds7

About N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide

N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide (PubChem CID 4938115) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide.

Molecular Properties

Compound NameN'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide
PubChem CID4938115
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC NameN'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1C
InChIInChI=1S/C24H24N2O4/c1-17-12-13-20(14-18(17)2)29-16-23(27)25-26-24(28)21-10-6-7-11-22(21)30-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyYJLASVSUXMWUDC-UHFFFAOYSA-N
XLogP3.72
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethylphenoxy)-N-(2-phenylmethoxyphenyl)acetamide
CID 17093514
2-(3,4-dimethylphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 4947508
N'-[2-(4-chloro-3-methylphenoxy)acetyl]-2-(2-methylpropoxy)benzohydrazide
CID 4945545
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-2-prop-2-enoxybenzohydrazide
CID 4929141
1-benzyl-N'-[2-(3,4-dimethylphenoxy)acetyl]-5-ethylpyrazole-4-carbohydrazide
CID 78872517
N'-[2-(3,4-dimethylphenoxy)acetyl]-2,4-dimethylbenzohydrazide
CID 27569378
2-butoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4941310
N'-benzoyl-2-phenylmethoxybenzohydrazide
CID 4938014
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
CID 17122878
2-[6-[(2-phenylmethoxybenzoyl)amino]naphthalen-2-yl]oxyacetic acid
CID 10137340
N-(3,4-dimethylphenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 1132550
3,4,5-trimethoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4938028

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide?
The IUPAC name of N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide (CID 4938115) is N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide.
What is the SMILES notation for N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide?
The canonical SMILES for N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide is Cc1ccc(OCC(=O)NNC(=O)c2ccccc2OCc2ccccc2)cc1C.
What is the InChIKey of N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide?
The InChIKey is YJLASVSUXMWUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-17-12-13-20(14-18(17)2)29-16-23(27)25-26-24(28)21-10-6-7-11-22(21)30-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide?
N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide has a molecular weight of 404.47 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3,4-dimethylphenoxy)acetyl]-2-phenylmethoxybenzohydrazide is sourced from PubChem (CID 4938115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).