N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide

C21H21NO3 — CID 94843861

IUPACN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESCOc1ccc([C@H](C)NC(=O)COc2ccc3ccccc3c2)cc1
InChIInChI=1S/C21H21NO3/c1-15(16-7-10-19(24-2)11-8-16)22-21(23)14-25-20-12-9-17-5-3-4-6-18(17)13-20/h3-13,15H,14H2,1-2H3,(H,22,23)/t15-/m0/s1
InChIKeyAMYZTLXMGNCBGK-HNNXBMFYSA-N
MW335.40 g/mol
LogP4.10
Rot. Bonds6

About N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide

N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide (PubChem CID 94843861) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
PubChem CID94843861
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC NameN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
SMILESCOc1ccc([C@H](C)NC(=O)COc2ccc3ccccc3c2)cc1
InChIInChI=1S/C21H21NO3/c1-15(16-7-10-19(24-2)11-8-16)22-21(23)14-25-20-12-9-17-5-3-4-6-18(17)13-20/h3-13,15H,14H2,1-2H3,(H,22,23)/t15-/m0/s1
InChIKeyAMYZTLXMGNCBGK-HNNXBMFYSA-N
XLogP4.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 42989419
2-(3-methoxyphenoxy)-N-(1-naphthalen-2-ylethyl)acetamide
CID 112779282
2-(3,5-dimethoxyphenoxy)-N-[(1R)-1-naphthalen-2-ylethyl]acetamide
CID 7714005
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(7-methoxynaphthalen-2-yl)oxyacetamide
CID 7652877
N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-2-naphthalen-2-yloxyacetamide
CID 26468178
2-(4-methoxyphenoxy)-N-[(1R)-1-phenylethyl]acetamide
CID 836085
N-[(S)-(4-methoxyphenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
CID 95180836
N-[(1S)-1-naphthalen-2-ylethyl]-2-phenoxyacetamide
CID 7899710
2-(3-chlorophenoxy)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 99133008
2-(3-methoxyphenoxy)-N-(1-phenylethyl)acetamide
CID 19204047
2-(4-methoxyphenyl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 974464
2-methoxy-N-(1-naphthalen-2-ylethyl)acetamide
CID 43011314

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide (CID 94843861) is N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide is COc1ccc([C@H](C)NC(=O)COc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
The InChIKey is AMYZTLXMGNCBGK-HNNXBMFYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-15(16-7-10-19(24-2)11-8-16)22-21(23)14-25-20-12-9-17-5-3-4-6-18(17)13-20/h3-13,15H,14H2,1-2H3,(H,22,23)/t15-/m0/s1.
What are the key properties of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide?
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide has a molecular weight of 335.40 g/mol, XLogP of 4.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 94843861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).