2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide

C22H19N3O3 — CID 7642098

IUPAC2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)NN=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19N3O3/c23-22(27)18-13-7-8-14-19(18)28-15-20(26)24-25-21(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2,(H2,23,27)(H,24,26)
InChIKeyGDGLRQAIVCWHOB-UHFFFAOYSA-N
MW373.41 g/mol
LogP2.73
Rot. Bonds7

About 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide

2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide (PubChem CID 7642098) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide
PubChem CID7642098
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide
SMILESNC(=O)c1ccccc1OCC(=O)NN=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H19N3O3/c23-22(27)18-13-7-8-14-19(18)28-15-20(26)24-25-21(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2,(H2,23,27)(H,24,26)
InChIKeyGDGLRQAIVCWHOB-UHFFFAOYSA-N
XLogP2.73
TPSA93.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenacyloxybenzamide
CID 43218588
2-[2-[2-[(2-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethoxy]benzamide
CID 3482224
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
methyl 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]-4-methoxybenzoate
CID 7705020
2-(4-acetyl-2-methoxyphenoxy)-N-(benzhydrylideneamino)acetamide
CID 7695777
N-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethyl]-2-ethoxybenzamide
CID 41375551
2-[2-(cyanoamino)-2-oxoethoxy]benzamide
CID 79194967
2-[2-[2-[2-(2-chlorophenoxy)acetyl]hydrazinyl]-2-oxoethoxy]benzamide
CID 9085660
(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
CID 54991568
methyl 2-(2-carbamoylphenoxy)acetate
CID 2772027
2-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethoxy]benzamide
CID 8866061
N-(benzhydrylideneamino)-2-(2,6-dimethoxy-4-methylphenoxy)acetamide
CID 7695561

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide (CID 7642098) is 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide is NC(=O)c1ccccc1OCC(=O)NN=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide?
The InChIKey is GDGLRQAIVCWHOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c23-22(27)18-13-7-8-14-19(18)28-15-20(26)24-25-21(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-14H,15H2,(H2,23,27)(H,24,26).
What are the key properties of 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide?
2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide has a molecular weight of 373.41 g/mol, XLogP of 2.73, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-benzhydrylidenehydrazinyl)-2-oxoethoxy]benzamide is sourced from PubChem (CID 7642098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).