3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide

C20H24N2O6 — CID 17139694

IUPAC3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
SMILESCCOCCOc1cccc(C(=O)NNC(=O)COc2ccc(OC)cc2)c1
InChIInChI=1S/C20H24N2O6/c1-3-26-11-12-27-18-6-4-5-15(13-18)20(24)22-21-19(23)14-28-17-9-7-16(25-2)8-10-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyJHELZGWMVNFQTH-UHFFFAOYSA-N
MW388.42 g/mol
LogP1.95
Rot. Bonds10

About 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide

3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide (PubChem CID 17139694) has the molecular formula C20H24N2O6 and a molecular weight of 388.42 g/mol. Its IUPAC name is 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide.

Molecular Properties

Compound Name3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
PubChem CID17139694
Molecular FormulaC20H24N2O6
Molecular Weight388.42 g/mol
Exact Mass388.16
IUPAC Name3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
SMILESCCOCCOc1cccc(C(=O)NNC(=O)COc2ccc(OC)cc2)c1
InChIInChI=1S/C20H24N2O6/c1-3-26-11-12-27-18-6-4-5-15(13-18)20(24)22-21-19(23)14-28-17-9-7-16(25-2)8-10-17/h4-10,13H,3,11-12,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyJHELZGWMVNFQTH-UHFFFAOYSA-N
XLogP1.95
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 51.95
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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Related Compounds

4-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 17112720
3-(2-ethoxyethoxy)-N'-(3-ethoxypropanoyl)benzohydrazide
CID 17139800
N'-butanoyl-3-(2-ethoxyethoxy)benzohydrazide
CID 17139798
N'-[2-(4-methoxyphenoxy)acetyl]-3-(2-phenylethoxy)benzohydrazide
CID 17134452
3-(2-ethoxyethoxy)-N'-[2-(2-methylphenoxy)acetyl]benzohydrazide
CID 17139730
N'-[2-(4-ethylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955139
N'-[2-(4-fluorophenoxy)acetyl]-3-methoxybenzohydrazide
CID 8880066
3-(2-ethoxyethoxy)-N'-(4-prop-2-enoxybenzoyl)benzohydrazide
CID 17139786
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
N'-(3-ethoxypropanoyl)-3-propoxybenzohydrazide
CID 17357962
N'-[2-(2-bromo-4-tert-butylphenoxy)acetyl]-3-(2-ethoxyethoxy)benzohydrazide
CID 17139777
3-(2-ethoxyethoxy)-N-[(4-methoxyphenyl)carbamothioyl]benzamide
CID 17139837

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide?
The IUPAC name of 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide (CID 17139694) is 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide.
What is the SMILES notation for 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide?
The canonical SMILES for 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide is CCOCCOc1cccc(C(=O)NNC(=O)COc2ccc(OC)cc2)c1.
What is the InChIKey of 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide?
The InChIKey is JHELZGWMVNFQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O6/c1-3-26-11-12-27-18-6-4-5-15(13-18)20(24)22-21-19(23)14-28-17-9-7-16(25-2)8-10-17/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-(4-methoxyphenoxy)acetyl]benzohydrazide?
3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide has a molecular weight of 388.42 g/mol, XLogP of 1.95, 10 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide is sourced from PubChem (CID 17139694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).