3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide

C15H15NO3 — CID 62326134

IUPAC3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide
SMILESCNC(=O)CCOc1ccc2ccccc2c1C=O
InChIInChI=1S/C15H15NO3/c1-16-15(18)8-9-19-14-7-6-11-4-2-3-5-12(11)13(14)10-17/h2-7,10H,8-9H2,1H3,(H,16,18)
InChIKeyVPJXWYZFDAFBFR-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.17
Rot. Bonds5

About 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide

3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide (PubChem CID 62326134) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide.

Molecular Properties

Compound Name3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide
PubChem CID62326134
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide
SMILESCNC(=O)CCOc1ccc2ccccc2c1C=O
InChIInChI=1S/C15H15NO3/c1-16-15(18)8-9-19-14-7-6-11-4-2-3-5-12(11)13(14)10-17/h2-7,10H,8-9H2,1H3,(H,16,18)
InChIKeyVPJXWYZFDAFBFR-UHFFFAOYSA-N
XLogP2.17
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.17
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-heptoxynaphthalene-1-carbaldehyde
CID 43505602
ethyl 6-(1-formylnaphthalen-2-yl)oxyhexanoate
CID 86662491
2-(1-formylnaphthalen-2-yl)oxy-N-naphthalen-1-ylacetamide
CID 7763473
2-(5-hydroxypentoxy)naphthalene-1-carbaldehyde
CID 62228685
N-methyl-3-(2-methylphenoxy)propanamide
CID 60637088
2-(3-methylsulfanylpropoxy)naphthalene-1-carbaldehyde
CID 115659116
2-(1-formylnaphthalen-2-yl)oxy-N-(2-methylphenyl)acetamide
CID 7763468
2-(1-formylnaphthalen-2-yl)oxy-N-(2-methylbutan-2-yl)acetamide
CID 9010002
2-(2-phenylethoxy)naphthalene-1-carbaldehyde
CID 22687262
(1-formylnaphthalen-2-yl) acetate
CID 2063426
2-(2-methylprop-2-enoxy)naphthalene-1-carbaldehyde
CID 4737132
2-(3-methylbut-2-enoxy)naphthalene-1-carbaldehyde
CID 10823964

Frequently Asked Questions

What is the IUPAC name of 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide?
The IUPAC name of 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide (CID 62326134) is 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide.
What is the SMILES notation for 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide?
The canonical SMILES for 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide is CNC(=O)CCOc1ccc2ccccc2c1C=O.
What is the InChIKey of 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide?
The InChIKey is VPJXWYZFDAFBFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-16-15(18)8-9-19-14-7-6-11-4-2-3-5-12(11)13(14)10-17/h2-7,10H,8-9H2,1H3,(H,16,18).
What are the key properties of 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide?
3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide has a molecular weight of 257.29 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-formylnaphthalen-2-yl)oxy-N-methylpropanamide is sourced from PubChem (CID 62326134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).