N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide

C24H25N3O3 — CID 5035424

IUPACN-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide
SMILESCCc1ccc(NC(=O)CC(C)=NNC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C24H25N3O3/c1-3-18-11-13-20(14-12-18)25-23(28)15-17(2)26-27-24(29)16-30-22-10-6-8-19-7-4-5-9-21(19)22/h4-14H,3,15-16H2,1-2H3,(H,25,28)(H,27,29)
InChIKeyNNOZVXPCKLNVLJ-UHFFFAOYSA-N
MW403.48 g/mol
LogP4.30
Rot. Bonds8

About N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide

N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide (PubChem CID 5035424) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide
PubChem CID5035424
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC NameN-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide
SMILESCCc1ccc(NC(=O)CC(C)=NNC(=O)COc2cccc3ccccc23)cc1
InChIInChI=1S/C24H25N3O3/c1-3-18-11-13-20(14-12-18)25-23(28)15-17(2)26-27-24(29)16-30-22-10-6-8-19-7-4-5-9-21(19)22/h4-14H,3,15-16H2,1-2H3,(H,25,28)(H,27,29)
InChIKeyNNOZVXPCKLNVLJ-UHFFFAOYSA-N
XLogP4.30
TPSA79.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 54.30
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-naphthalen-1-yloxy-N-[(Z)-1-phenylethylideneamino]acetamide
CID 5404956
N-[4-(dimethylamino)phenyl]-3-[[2-(2-methoxyphenoxy)acetyl]hydrazinylidene]butanamide
CID 3780148
N-(4-methoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 835733
N-(4-fluorophenyl)-3-[(2-phenoxyacetyl)hydrazinylidene]butanamide
CID 15945779
N-(9-ethylcarbazol-3-yl)-3-[[2-(2-methylphenoxy)acetyl]hydrazinylidene]butanamide
CID 3107349
N-[4-(dimethylamino)phenyl]-2-naphthalen-1-yloxyacetamide
CID 2327581
N-[4-[(2R)-butan-2-yl]phenyl]-2-naphthalen-1-yloxyacetamide
CID 7765844
N'-[[4-(4-anilinoanilino)-4-oxobutan-2-ylidene]amino]-N-(4-ethylphenyl)oxamide
CID 3976663
N-(4-ethylphenyl)-2-[(1-oxo-2H-isoquinolin-5-yl)oxy]acetamide
CID 43985399
3-[[2-(2-bromo-4-chlorophenoxy)acetyl]hydrazinylidene]-N-naphthalen-2-ylbutanamide
CID 5067981
2-naphthalen-1-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 94848502
N-(3,4-diethoxyphenyl)-2-naphthalen-1-yloxyacetamide
CID 7860223

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide?
The IUPAC name of N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide (CID 5035424) is N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide.
What is the SMILES notation for N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide?
The canonical SMILES for N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide is CCc1ccc(NC(=O)CC(C)=NNC(=O)COc2cccc3ccccc23)cc1.
What is the InChIKey of N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide?
The InChIKey is NNOZVXPCKLNVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c1-3-18-11-13-20(14-12-18)25-23(28)15-17(2)26-27-24(29)16-30-22-10-6-8-19-7-4-5-9-21(19)22/h4-14H,3,15-16H2,1-2H3,(H,25,28)(H,27,29).
What are the key properties of N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide?
N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide has a molecular weight of 403.48 g/mol, XLogP of 4.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-3-[(2-naphthalen-1-yloxyacetyl)hydrazinylidene]butanamide is sourced from PubChem (CID 5035424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).