N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide

C22H23ClN2O2 — CID 43003288

IUPACN-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESCN(C)C(CNC(=O)COc1ccc2ccccc2c1)c1ccccc1Cl
InChIInChI=1S/C22H23ClN2O2/c1-25(2)21(19-9-5-6-10-20(19)23)14-24-22(26)15-27-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,21H,14-15H2,1-2H3,(H,24,26)
InChIKeyHZXRNURIZONJQQ-UHFFFAOYSA-N
MW382.89 g/mol
LogP4.29
Rot. Bonds7

About N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide

N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 43003288) has the molecular formula C22H23ClN2O2 and a molecular weight of 382.89 g/mol. Its IUPAC name is N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide
PubChem CID43003288
Molecular FormulaC22H23ClN2O2
Molecular Weight382.89 g/mol
Exact Mass382.14
IUPAC NameN-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESCN(C)C(CNC(=O)COc1ccc2ccccc2c1)c1ccccc1Cl
InChIInChI=1S/C22H23ClN2O2/c1-25(2)21(19-9-5-6-10-20(19)23)14-24-22(26)15-27-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,21H,14-15H2,1-2H3,(H,24,26)
InChIKeyHZXRNURIZONJQQ-UHFFFAOYSA-N
XLogP4.29
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.89
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide (CID 43003288) is N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide is CN(C)C(CNC(=O)COc1ccc2ccccc2c1)c1ccccc1Cl.
What is the InChIKey of N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is HZXRNURIZONJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23ClN2O2/c1-25(2)21(19-9-5-6-10-20(19)23)14-24-22(26)15-27-18-12-11-16-7-3-4-8-17(16)13-18/h3-13,21H,14-15H2,1-2H3,(H,24,26).
What are the key properties of N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide?
N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 382.89 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 43003288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).