2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide

C18H19N3O5 — CID 9086453

IUPAC2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide
SMILESCCOc1ccc(C(=O)NNC(=O)COc2ccccc2C(N)=O)cc1
InChIInChI=1S/C18H19N3O5/c1-2-25-13-9-7-12(8-10-13)18(24)21-20-16(22)11-26-15-6-4-3-5-14(15)17(19)23/h3-10H,2,11H2,1H3,(H2,19,23)(H,20,22)(H,21,24)
InChIKeyMRKQNFFFVBAEBB-UHFFFAOYSA-N
MW357.37 g/mol
LogP1.02
Rot. Bonds7

About 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide

2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide (PubChem CID 9086453) has the molecular formula C18H19N3O5 and a molecular weight of 357.37 g/mol. Its IUPAC name is 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide
PubChem CID9086453
Molecular FormulaC18H19N3O5
Molecular Weight357.37 g/mol
Exact Mass357.13
IUPAC Name2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide
SMILESCCOc1ccc(C(=O)NNC(=O)COc2ccccc2C(N)=O)cc1
InChIInChI=1S/C18H19N3O5/c1-2-25-13-9-7-12(8-10-13)18(24)21-20-16(22)11-26-15-6-4-3-5-14(15)17(19)23/h3-10H,2,11H2,1H3,(H2,19,23)(H,20,22)(H,21,24)
InChIKeyMRKQNFFFVBAEBB-UHFFFAOYSA-N
XLogP1.02
TPSA119.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-ethoxyphenoxy)acetyl]-4-methylbenzohydrazide
CID 7918380
N'-[2-(2-ethoxyphenoxy)acetyl]-4-(3-methylbutoxy)benzohydrazide
CID 55334035
N'-[2-(2-methoxyphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
CID 4952895
ethyl 4-[2-[2-[2-(2-methoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17355650
ethyl 4-[2-[2-[(2-ethoxybenzoyl)carbamothioyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 4932870
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
N'-[2-(2,5-dimethylphenoxy)acetyl]-4-ethoxybenzohydrazide
CID 26845933
propyl 4-[2-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 17122909
2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
CID 9085660
2-(4-ethoxyphenoxy)-N'-[2-(2-methylphenoxy)acetyl]acetohydrazide
CID 7700204
4-ethoxy-N'-[2-[4-(trifluoromethyl)phenoxy]acetyl]benzohydrazide
CID 55786703
N'-(2-naphthalen-1-yloxyacetyl)-4-propoxybenzohydrazide
CID 4938673

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide (CID 9086453) is 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide is CCOc1ccc(C(=O)NNC(=O)COc2ccccc2C(N)=O)cc1.
What is the InChIKey of 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide?
The InChIKey is MRKQNFFFVBAEBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O5/c1-2-25-13-9-7-12(8-10-13)18(24)21-20-16(22)11-26-15-6-4-3-5-14(15)17(19)23/h3-10H,2,11H2,1H3,(H2,19,23)(H,20,22)(H,21,24).
What are the key properties of 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide?
2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide has a molecular weight of 357.37 g/mol, XLogP of 1.02, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethoxy]benzamide is sourced from PubChem (CID 9086453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).