2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide

C21H21NO2 — CID 112781691

IUPAC2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)COc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C21H21NO2/c1-16(2)22(19-10-4-3-5-11-19)21(23)15-24-20-13-12-17-8-6-7-9-18(17)14-20/h3-14,16H,15H2,1-2H3
InChIKeyXPGHDIGMRSTNCP-UHFFFAOYSA-N
MW319.40 g/mol
LogP4.66
Rot. Bonds5

About 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide

2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide (PubChem CID 112781691) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide
PubChem CID112781691
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide
SMILESCC(C)N(C(=O)COc1ccc2ccccc2c1)c1ccccc1
InChIInChI=1S/C21H21NO2/c1-16(2)22(19-10-4-3-5-11-19)21(23)15-24-20-13-12-17-8-6-7-9-18(17)14-20/h3-14,16H,15H2,1-2H3
InChIKeyXPGHDIGMRSTNCP-UHFFFAOYSA-N
XLogP4.66
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide (CID 112781691) is 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide is CC(C)N(C(=O)COc1ccc2ccccc2c1)c1ccccc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide?
The InChIKey is XPGHDIGMRSTNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO2/c1-16(2)22(19-10-4-3-5-11-19)21(23)15-24-20-13-12-17-8-6-7-9-18(17)14-20/h3-14,16H,15H2,1-2H3.
What are the key properties of 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide?
2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide has a molecular weight of 319.40 g/mol, XLogP of 4.66, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-phenyl-N-propan-2-ylacetamide is sourced from PubChem (CID 112781691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).