3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide

C20H24N2O5 — CID 17139730

IUPAC3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
SMILESCCOCCOc1cccc(C(=O)NNC(=O)COc2ccccc2C)c1
InChIInChI=1S/C20H24N2O5/c1-3-25-11-12-26-17-9-6-8-16(13-17)20(24)22-21-19(23)14-27-18-10-5-4-7-15(18)2/h4-10,13H,3,11-12,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyKZIBPLSWAVPLNT-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.25
Rot. Bonds9

About 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide

3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide (PubChem CID 17139730) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
PubChem CID17139730
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC Name3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
SMILESCCOCCOc1cccc(C(=O)NNC(=O)COc2ccccc2C)c1
InChIInChI=1S/C20H24N2O5/c1-3-25-11-12-26-17-9-6-8-16(13-17)20(24)22-21-19(23)14-27-18-10-5-4-7-15(18)2/h4-10,13H,3,11-12,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyKZIBPLSWAVPLNT-UHFFFAOYSA-N
XLogP2.25
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.25
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

3-(3-methylbutoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 4981813
3-(2-ethoxyethoxy)-N'-(3-ethoxypropanoyl)benzohydrazide
CID 17139800
3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 17139694
N'-butanoyl-3-(2-ethoxyethoxy)benzohydrazide
CID 17139798
3-butan-2-yloxy-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 17149889
3-bromo-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 7719967
3-cyano-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 8696563
N'-[2-(2-bromo-4-tert-butylphenoxy)acetyl]-3-(2-ethoxyethoxy)benzohydrazide
CID 17139777
N'-(3-ethoxypropanoyl)-3-propoxybenzohydrazide
CID 17357962
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
N'-[2-(4-chloro-2-methylphenoxy)acetyl]-3-ethoxybenzohydrazide
CID 4957534
3-methoxy-N'-[2-(2-methoxyphenoxy)acetyl]benzohydrazide
CID 7720061

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The IUPAC name of 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide (CID 17139730) is 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide is CCOCCOc1cccc(C(=O)NNC(=O)COc2ccccc2C)c1.
What is the InChIKey of 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
The InChIKey is KZIBPLSWAVPLNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-3-25-11-12-26-17-9-6-8-16(13-17)20(24)22-21-19(23)14-27-18-10-5-4-7-15(18)2/h4-10,13H,3,11-12,14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide?
3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 2.25, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 17139730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).