2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide

C23H17NO3 — CID 7763473

IUPAC2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide
SMILESO=Cc1c(OCC(=O)Nc2cccc3ccccc23)ccc2ccccc12
InChIInChI=1S/C23H17NO3/c25-14-20-18-9-3-1-7-17(18)12-13-22(20)27-15-23(26)24-21-11-5-8-16-6-2-4-10-19(16)21/h1-14H,15H2,(H,24,26)
InChIKeyUODAIWHODHDLRT-UHFFFAOYSA-N
MW355.39 g/mol
LogP4.82
Rot. Bonds5

About 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide

2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide (PubChem CID 7763473) has the molecular formula C23H17NO3 and a molecular weight of 355.39 g/mol. Its IUPAC name is 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide
PubChem CID7763473
Molecular FormulaC23H17NO3
Molecular Weight355.39 g/mol
Exact Mass355.12
IUPAC Name2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide
SMILESO=Cc1c(OCC(=O)Nc2cccc3ccccc23)ccc2ccccc12
InChIInChI=1S/C23H17NO3/c25-14-20-18-9-3-1-7-17(18)12-13-22(20)27-15-23(26)24-21-11-5-8-16-6-2-4-10-19(16)21/h1-14H,15H2,(H,24,26)
InChIKeyUODAIWHODHDLRT-UHFFFAOYSA-N
XLogP4.82
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(1-formylnaphthalen-2-yl)oxy-N-(2-methylphenyl)acetamide
CID 7763468
N-(3,4-dimethoxyphenyl)-2-(1-formylnaphthalen-2-yl)oxyacetamide
CID 7763592
2-(2,3-dimethylphenoxy)-N-naphthalen-1-ylacetamide
CID 720683
2-(1-formylnaphthalen-2-yl)oxy-N-(2-methylbutan-2-yl)acetamide
CID 9010002
ethyl 4-[[2-(1-formylnaphthalen-2-yl)oxyacetyl]amino]benzoate
CID 7763576
2-(4-bromo-2-methylphenoxy)-N-naphthalen-1-ylacetamide
CID 1328520
N-[(4-chlorophenyl)methyl]-2-(1-formylnaphthalen-2-yl)oxyacetamide
CID 7763455
N-[(4-fluorophenyl)methyl]-2-(1-formylnaphthalen-2-yl)oxyacetamide
CID 7763182
2-(1-formylnaphthalen-2-yl)oxy-N-(1-phenylethyl)acetamide
CID 51140286
3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide
CID 62326134
2-(2-methylprop-2-enoxy)naphthalene-1-carbaldehyde
CID 4737132
2-(2-methoxy-4-methylphenoxy)-N-naphthalen-1-ylacetamide
CID 2627702

Frequently Asked Questions

What is the IUPAC name of 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide (CID 7763473) is 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide is O=Cc1c(OCC(=O)Nc2cccc3ccccc23)ccc2ccccc12.
What is the InChIKey of 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide?
The InChIKey is UODAIWHODHDLRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO3/c25-14-20-18-9-3-1-7-17(18)12-13-22(20)27-15-23(26)24-21-11-5-8-16-6-2-4-10-19(16)21/h1-14H,15H2,(H,24,26).
What are the key properties of 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide?
2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide has a molecular weight of 355.39 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 7763473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).