(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide

C23H24N2O4 — CID 8960553

IUPAC(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide
SMILESCCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O4/c1-3-28-19-11-13-20(14-12-19)29-16(2)23(27)25-24-22(26)15-18-9-6-8-17-7-4-5-10-21(17)18/h4-14,16H,3,15H2,1-2H3,(H,24,26)(H,25,27)/t16-/m0/s1
InChIKeyFLUWEUGBPRIDQU-INIZCTEOSA-N
MW392.46 g/mol
LogP3.40
Rot. Bonds7

About (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide

(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide (PubChem CID 8960553) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide.

Molecular Properties

Compound Name(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide
PubChem CID8960553
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC Name(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide
SMILESCCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O4/c1-3-28-19-11-13-20(14-12-19)29-16(2)23(27)25-24-22(26)15-18-9-6-8-17-7-4-5-10-21(17)18/h4-14,16H,3,15H2,1-2H3,(H,24,26)(H,25,27)/t16-/m0/s1
InChIKeyFLUWEUGBPRIDQU-INIZCTEOSA-N
XLogP3.40
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-(4-ethoxyphenoxy)-N'-[2-(2-methylphenyl)acetyl]propanehydrazide
CID 8573981
2-(4-ethoxyphenoxy)-N'-[2-(2-methylphenyl)acetyl]propanehydrazide
CID 78727477
N'-[2-(4-ethoxyphenoxy)propanoyl]-2-phenoxypropanehydrazide
CID 42908805
N'-[2-(4-ethoxyphenoxy)propanoyl]-4-phenoxybutanehydrazide
CID 43003788
(E)-3-(4-ethoxyphenyl)-N'-(2-naphthalen-1-ylacetyl)prop-2-enehydrazide
CID 17227282
2-(2,3-dimethylphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide
CID 24634640
(2S)-N'-[2-(3-chlorophenoxy)acetyl]-2-(4-ethoxyphenoxy)propanehydrazide
CID 9343185
N-[(1S)-3-[2-[(2S)-2-(4-ethoxyphenoxy)propanoyl]hydrazinyl]-3-oxo-1-phenylpropyl]acetamide
CID 9343396
2-(4-ethylphenoxy)-N'-(2-phenylacetyl)propanehydrazide
CID 4953447
2-(2,3-dimethylphenoxy)-N'-[2-(4-ethoxyphenyl)acetyl]propanehydrazide
CID 78780492
(2R)-2-naphthalen-2-yloxy-N'-propanoylpropanehydrazide
CID 8757548
N'-(2-ethoxyacetyl)-2-phenoxypropanehydrazide
CID 17140894

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide?
The IUPAC name of (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide (CID 8960553) is (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide.
What is the SMILES notation for (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide?
The canonical SMILES for (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide is CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2cccc3ccccc23)cc1.
What is the InChIKey of (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide?
The InChIKey is FLUWEUGBPRIDQU-INIZCTEOSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-3-28-19-11-13-20(14-12-19)29-16(2)23(27)25-24-22(26)15-18-9-6-8-17-7-4-5-10-21(17)18/h4-14,16H,3,15H2,1-2H3,(H,24,26)(H,25,27)/t16-/m0/s1.
What are the key properties of (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide?
(2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide has a molecular weight of 392.46 g/mol, XLogP of 3.40, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-ethoxyphenoxy)-N'-(2-naphthalen-1-ylacetyl)propanehydrazide is sourced from PubChem (CID 8960553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).