4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide

C20H24N2O3 — CID 9492761

IUPAC4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide
SMILESCCC[C@@H](C(=O)NNC(=O)c1ccc(OCC)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O3/c1-3-8-18(15-9-6-5-7-10-15)20(24)22-21-19(23)16-11-13-17(14-12-16)25-4-2/h5-7,9-14,18H,3-4,8H2,1-2H3,(H,21,23)(H,22,24)/t18-/m1/s1
InChIKeyGYGKJSRXSMGAPA-GOSISDBHSA-N
MW340.42 g/mol
LogP3.43
Rot. Bonds7

About 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide

4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide (PubChem CID 9492761) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide.

Molecular Properties

Compound Name4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide
PubChem CID9492761
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide
SMILESCCC[C@@H](C(=O)NNC(=O)c1ccc(OCC)cc1)c1ccccc1
InChIInChI=1S/C20H24N2O3/c1-3-8-18(15-9-6-5-7-10-15)20(24)22-21-19(23)16-11-13-17(14-12-16)25-4-2/h5-7,9-14,18H,3-4,8H2,1-2H3,(H,21,23)(H,22,24)/t18-/m1/s1
InChIKeyGYGKJSRXSMGAPA-GOSISDBHSA-N
XLogP3.43
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-ethoxy-3-methoxy-N'-(2-phenylpentanoyl)benzohydrazide
CID 78585454
N-(4-ethoxyphenyl)-2-phenylpentanamide
CID 112760775
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
4-ethoxy-N'-phenylbenzohydrazide
CID 12065813
[(2R)-1-(2-benzoylhydrazinyl)-1-oxopropan-2-yl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 8943779
N'-(2,2-diphenylacetyl)-4-phenylmethoxybenzohydrazide
CID 4933138
2-benzyl-N'-(4-ethoxybenzoyl)benzohydrazide
CID 26187389
4-ethoxy-N-(2-phenylbutyl)benzamide
CID 17462842
(2S)-N'-[2-(2-methylphenoxy)acetyl]-2-phenylpentanehydrazide
CID 9470073
N'-(4-ethoxybenzoyl)pyridine-4-carbohydrazide
CID 959949
N-[(2R)-1-[2-(4-ethoxybenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]acetamide
CID 7479586
4-ethoxy-N-(5-hydroxy-3-phenylpentyl)benzamide
CID 121112163

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide?
The IUPAC name of 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide (CID 9492761) is 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide.
What is the SMILES notation for 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide?
The canonical SMILES for 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide is CCC[C@@H](C(=O)NNC(=O)c1ccc(OCC)cc1)c1ccccc1.
What is the InChIKey of 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide?
The InChIKey is GYGKJSRXSMGAPA-GOSISDBHSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-3-8-18(15-9-6-5-7-10-15)20(24)22-21-19(23)16-11-13-17(14-12-16)25-4-2/h5-7,9-14,18H,3-4,8H2,1-2H3,(H,21,23)(H,22,24)/t18-/m1/s1.
What are the key properties of 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide?
4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide has a molecular weight of 340.42 g/mol, XLogP of 3.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N'-[(2R)-2-phenylpentanoyl]benzohydrazide is sourced from PubChem (CID 9492761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).