2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide

C20H20N2O — CID 8901088

IUPAC2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide
SMILESCN(CC(=O)Nc1cccc2ccccc12)Cc1ccccc1
InChIInChI=1S/C20H20N2O/c1-22(14-16-8-3-2-4-9-16)15-20(23)21-19-13-7-11-17-10-5-6-12-18(17)19/h2-13H,14-15H2,1H3,(H,21,23)
InChIKeyHGTVAABYSCOWRP-UHFFFAOYSA-N
MW304.39 g/mol
LogP3.91
Rot. Bonds5

About 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide

2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide (PubChem CID 8901088) has the molecular formula C20H20N2O and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide.

Molecular Properties

Compound Name2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide
PubChem CID8901088
Molecular FormulaC20H20N2O
Molecular Weight304.39 g/mol
Exact Mass304.16
IUPAC Name2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide
SMILESCN(CC(=O)Nc1cccc2ccccc12)Cc1ccccc1
InChIInChI=1S/C20H20N2O/c1-22(14-16-8-3-2-4-9-16)15-20(23)21-19-13-7-11-17-10-5-6-12-18(17)19/h2-13H,14-15H2,1H3,(H,21,23)
InChIKeyHGTVAABYSCOWRP-UHFFFAOYSA-N
XLogP3.91
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide?
The IUPAC name of 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide (CID 8901088) is 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide.
What is the SMILES notation for 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide?
The canonical SMILES for 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide is CN(CC(=O)Nc1cccc2ccccc12)Cc1ccccc1.
What is the InChIKey of 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide?
The InChIKey is HGTVAABYSCOWRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O/c1-22(14-16-8-3-2-4-9-16)15-20(23)21-19-13-7-11-17-10-5-6-12-18(17)19/h2-13H,14-15H2,1H3,(H,21,23).
What are the key properties of 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide?
2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide has a molecular weight of 304.39 g/mol, XLogP of 3.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(methyl)amino]-N-naphthalen-1-ylacetamide is sourced from PubChem (CID 8901088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).