N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide

C20H17Cl2NO2 — CID 16546242

IUPACN-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C20H17Cl2NO2/c21-17-7-5-15(19(22)12-17)9-10-23-20(24)13-25-18-8-6-14-3-1-2-4-16(14)11-18/h1-8,11-12H,9-10,13H2,(H,23,24)
InChIKeyCJVVOXODIAWRTF-UHFFFAOYSA-N
MW374.27 g/mol
LogP4.88
Rot. Bonds6

About N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide

N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 16546242) has the molecular formula C20H17Cl2NO2 and a molecular weight of 374.27 g/mol. Its IUPAC name is N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide
PubChem CID16546242
Molecular FormulaC20H17Cl2NO2
Molecular Weight374.27 g/mol
Exact Mass373.06
IUPAC NameN-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESO=C(COc1ccc2ccccc2c1)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C20H17Cl2NO2/c21-17-7-5-15(19(22)12-17)9-10-23-20(24)13-25-18-8-6-14-3-1-2-4-16(14)11-18/h1-8,11-12H,9-10,13H2,(H,23,24)
InChIKeyCJVVOXODIAWRTF-UHFFFAOYSA-N
XLogP4.88
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.27
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide (CID 16546242) is N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide is O=C(COc1ccc2ccccc2c1)NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is CJVVOXODIAWRTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17Cl2NO2/c21-17-7-5-15(19(22)12-17)9-10-23-20(24)13-25-18-8-6-14-3-1-2-4-16(14)11-18/h1-8,11-12H,9-10,13H2,(H,23,24).
What are the key properties of N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 374.27 g/mol, XLogP of 4.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dichlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 16546242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).