N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide

C23H24N2O4 — CID 4502710

IUPACN'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide
SMILESCC(C)c1ccc(OCC(=O)NNC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O4/c1-16(2)17-10-12-19(13-11-17)28-14-22(26)24-25-23(27)15-29-21-9-5-7-18-6-3-4-8-20(18)21/h3-13,16H,14-15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyOROHJLPJMMIXDQ-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.57
Rot. Bonds7

About N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide

N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide (PubChem CID 4502710) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide.

Molecular Properties

Compound NameN'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide
PubChem CID4502710
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide
SMILESCC(C)c1ccc(OCC(=O)NNC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C23H24N2O4/c1-16(2)17-10-12-19(13-11-17)28-14-22(26)24-25-23(27)15-29-21-9-5-7-18-6-3-4-8-20(18)21/h3-13,16H,14-15H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyOROHJLPJMMIXDQ-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
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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Frequently Asked Questions

What is the IUPAC name of N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide?
The IUPAC name of N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide (CID 4502710) is N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide.
What is the SMILES notation for N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide?
The canonical SMILES for N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide is CC(C)c1ccc(OCC(=O)NNC(=O)COc2cccc3ccccc23)cc1.
What is the InChIKey of N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide?
The InChIKey is OROHJLPJMMIXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-16(2)17-10-12-19(13-11-17)28-14-22(26)24-25-23(27)15-29-21-9-5-7-18-6-3-4-8-20(18)21/h3-13,16H,14-15H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide?
N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide has a molecular weight of 392.46 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-naphthalen-1-yloxyacetyl)-2-(4-propan-2-ylphenoxy)acetohydrazide is sourced from PubChem (CID 4502710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).