N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide

C20H19NO — CID 1228165

IUPACN-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
SMILESCc1cccc(NC(=O)Cc2cccc3ccccc23)c1C
InChIInChI=1S/C20H19NO/c1-14-7-5-12-19(15(14)2)21-20(22)13-17-10-6-9-16-8-3-4-11-18(16)17/h3-12H,13H2,1-2H3,(H,21,22)
InChIKeyLGMHQJUAXYUIKT-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.64
Rot. Bonds3

About N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide

N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide (PubChem CID 1228165) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
PubChem CID1228165
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC NameN-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
SMILESCc1cccc(NC(=O)Cc2cccc3ccccc23)c1C
InChIInChI=1S/C20H19NO/c1-14-7-5-12-19(15(14)2)21-20(22)13-17-10-6-9-16-8-3-4-11-18(16)17/h3-12H,13H2,1-2H3,(H,21,22)
InChIKeyLGMHQJUAXYUIKT-UHFFFAOYSA-N
XLogP4.64
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide (CID 1228165) is N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide is Cc1cccc(NC(=O)Cc2cccc3ccccc23)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide?
The InChIKey is LGMHQJUAXYUIKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-14-7-5-12-19(15(14)2)21-20(22)13-17-10-6-9-16-8-3-4-11-18(16)17/h3-12H,13H2,1-2H3,(H,21,22).
What are the key properties of N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide?
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide has a molecular weight of 289.38 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 1228165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).