N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide

C21H26N2O5 — CID 17122823

IUPACN'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
SMILESCCOCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1C
InChIInChI=1S/C21H26N2O5/c1-4-26-11-12-27-19-8-6-5-7-17(19)21(25)23-22-20(24)14-28-18-10-9-15(2)13-16(18)3/h5-10,13H,4,11-12,14H2,1-3H3,(H,22,24)(H,23,25)
InChIKeyFBFHRZKSUKWJGG-UHFFFAOYSA-N
MW386.45 g/mol
LogP2.56
Rot. Bonds9

About N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide

N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide (PubChem CID 17122823) has the molecular formula C21H26N2O5 and a molecular weight of 386.45 g/mol. Its IUPAC name is N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide.

Molecular Properties

Compound NameN'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
PubChem CID17122823
Molecular FormulaC21H26N2O5
Molecular Weight386.45 g/mol
Exact Mass386.18
IUPAC NameN'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
SMILESCCOCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1C
InChIInChI=1S/C21H26N2O5/c1-4-26-11-12-27-19-8-6-5-7-17(19)21(25)23-22-20(24)14-28-18-10-9-15(2)13-16(18)3/h5-10,13H,4,11-12,14H2,1-3H3,(H,22,24)(H,23,25)
InChIKeyFBFHRZKSUKWJGG-UHFFFAOYSA-N
XLogP2.56
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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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Related Compounds

2-chloro-N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 909280
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide
CID 17122878
N'-(2-ethoxyacetyl)-2-(2-methoxyethoxy)benzohydrazide
CID 17140943
N-[[[2-(2,4-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-pentoxybenzamide
CID 4947294
N'-[2-(2,4-dimethylphenoxy)acetyl]benzohydrazide
CID 909269
N'-(2-ethoxyacetyl)-2-(2-phenoxyethoxy)benzohydrazide
CID 17140922
1-(2-ethoxyethoxy)-2,4-dimethylbenzene
CID 60644510
2-(2,4-dimethylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]acetohydrazide
CID 4500297
N'-[2-(4-methylphenoxy)acetyl]-2-propoxybenzohydrazide
CID 4931603
N'-[2-(3-methylphenoxy)acetyl]-2-propoxybenzohydrazide
CID 4931604
propyl 4-[2-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17122909
2-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 17122844

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide?
The IUPAC name of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide (CID 17122823) is N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide.
What is the SMILES notation for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide?
The canonical SMILES for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide is CCOCCOc1ccccc1C(=O)NNC(=O)COc1ccc(C)cc1C.
What is the InChIKey of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide?
The InChIKey is FBFHRZKSUKWJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O5/c1-4-26-11-12-27-19-8-6-5-7-17(19)21(25)23-22-20(24)14-28-18-10-9-15(2)13-16(18)3/h5-10,13H,4,11-12,14H2,1-3H3,(H,22,24)(H,23,25).
What are the key properties of N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide?
N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide has a molecular weight of 386.45 g/mol, XLogP of 2.56, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,4-dimethylphenoxy)acetyl]-2-(2-ethoxyethoxy)benzohydrazide is sourced from PubChem (CID 17122823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).