N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide

C21H20N2O2 — CID 4942535

IUPACN,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide
SMILESCN(C)C(=O)c1ccccc1NC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C21H20N2O2/c1-23(2)21(25)18-12-5-6-13-19(18)22-20(24)14-16-10-7-9-15-8-3-4-11-17(15)16/h3-13H,14H2,1-2H3,(H,22,24)
InChIKeyYTQDMFXHOICLIQ-UHFFFAOYSA-N
MW332.40 g/mol
LogP3.72
Rot. Bonds4

About N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide

N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide (PubChem CID 4942535) has the molecular formula C21H20N2O2 and a molecular weight of 332.40 g/mol. Its IUPAC name is N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide
PubChem CID4942535
Molecular FormulaC21H20N2O2
Molecular Weight332.40 g/mol
Exact Mass332.15
IUPAC NameN,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide
SMILESCN(C)C(=O)c1ccccc1NC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C21H20N2O2/c1-23(2)21(25)18-12-5-6-13-19(18)22-20(24)14-16-10-7-9-15-8-3-4-11-17(15)16/h3-13H,14H2,1-2H3,(H,22,24)
InChIKeyYTQDMFXHOICLIQ-UHFFFAOYSA-N
XLogP3.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide?
The IUPAC name of N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide (CID 4942535) is N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide.
What is the SMILES notation for N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide?
The canonical SMILES for N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide is CN(C)C(=O)c1ccccc1NC(=O)Cc1cccc2ccccc12.
What is the InChIKey of N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide?
The InChIKey is YTQDMFXHOICLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O2/c1-23(2)21(25)18-12-5-6-13-19(18)22-20(24)14-16-10-7-9-15-8-3-4-11-17(15)16/h3-13H,14H2,1-2H3,(H,22,24).
What are the key properties of N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide?
N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide has a molecular weight of 332.40 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(2-naphthalen-1-ylacetyl)amino]benzamide is sourced from PubChem (CID 4942535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).