N-methoxy-8-naphthalen-2-yl-8-oxooctanamide

C19H23NO3 — CID 23072474

IUPACN-methoxy-8-naphthalen-2-yl-8-oxooctanamide
SMILESCONC(=O)CCCCCCC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H23NO3/c1-23-20-19(22)11-5-3-2-4-10-18(21)17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3,(H,20,22)
InChIKeyXEOODGRTLNAURF-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.04
Rot. Bonds9

About N-methoxy-8-naphthalen-2-yl-8-oxooctanamide

N-methoxy-8-naphthalen-2-yl-8-oxooctanamide (PubChem CID 23072474) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-methoxy-8-naphthalen-2-yl-8-oxooctanamide.

Molecular Properties

Compound NameN-methoxy-8-naphthalen-2-yl-8-oxooctanamide
PubChem CID23072474
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-methoxy-8-naphthalen-2-yl-8-oxooctanamide
SMILESCONC(=O)CCCCCCC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C19H23NO3/c1-23-20-19(22)11-5-3-2-4-10-18(21)17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3,(H,20,22)
InChIKeyXEOODGRTLNAURF-UHFFFAOYSA-N
XLogP4.04
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-8-naphthalen-2-yl-8-oxooctanamide?
The IUPAC name of N-methoxy-8-naphthalen-2-yl-8-oxooctanamide (CID 23072474) is N-methoxy-8-naphthalen-2-yl-8-oxooctanamide.
What is the SMILES notation for N-methoxy-8-naphthalen-2-yl-8-oxooctanamide?
The canonical SMILES for N-methoxy-8-naphthalen-2-yl-8-oxooctanamide is CONC(=O)CCCCCCC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-methoxy-8-naphthalen-2-yl-8-oxooctanamide?
The InChIKey is XEOODGRTLNAURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-23-20-19(22)11-5-3-2-4-10-18(21)17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3,(H,20,22).
What are the key properties of N-methoxy-8-naphthalen-2-yl-8-oxooctanamide?
N-methoxy-8-naphthalen-2-yl-8-oxooctanamide has a molecular weight of 313.40 g/mol, XLogP of 4.04, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-8-naphthalen-2-yl-8-oxooctanamide is sourced from PubChem (CID 23072474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).