N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide

C21H18F3NO — CID 8025350

IUPACN-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESC[C@@H](NC(=O)Cc1cccc(C(F)(F)F)c1)c1ccc2ccccc2c1
InChIInChI=1S/C21H18F3NO/c1-14(17-10-9-16-6-2-3-7-18(16)13-17)25-20(26)12-15-5-4-8-19(11-15)21(22,23)24/h2-11,13-14H,12H2,1H3,(H,25,26)/t14-/m1/s1
InChIKeyDVISFRJQJFTZQH-CQSZACIVSA-N
MW357.38 g/mol
LogP5.28
Rot. Bonds4

About N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide

N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 8025350) has the molecular formula C21H18F3NO and a molecular weight of 357.38 g/mol. Its IUPAC name is N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID8025350
Molecular FormulaC21H18F3NO
Molecular Weight357.38 g/mol
Exact Mass357.13
IUPAC NameN-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESC[C@@H](NC(=O)Cc1cccc(C(F)(F)F)c1)c1ccc2ccccc2c1
InChIInChI=1S/C21H18F3NO/c1-14(17-10-9-16-6-2-3-7-18(16)13-17)25-20(26)12-15-5-4-8-19(11-15)21(22,23)24/h2-11,13-14H,12H2,1H3,(H,25,26)/t14-/m1/s1
InChIKeyDVISFRJQJFTZQH-CQSZACIVSA-N
XLogP5.28
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.38
LogP ≤ 55.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-[4-(dimethylsulfamoyl)phenyl]ethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 60535017
N-(1-hydroxypropan-2-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 43418851
N-(4-propan-2-ylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 4848940
N-[1-[3-(pyridin-2-ylmethoxy)phenyl]ethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 55902507
2-(2-chlorophenyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 42907102
2-(4-methoxyphenyl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 974464
methyl 2-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]propanoate
CID 60637965
3-methyl-2-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]butanoic acid
CID 43238852
2-(4-ethoxyphenyl)-N-[(1S)-1-[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 26010093
2-(4-ethoxyphenyl)-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 26010094
2-(3-fluoro-4-methoxyphenyl)-N-(1-naphthalen-2-ylethyl)acetamide
CID 46599158
N-(1-naphthalen-2-ylethyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide
CID 51149094

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide (CID 8025350) is N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide is C[C@@H](NC(=O)Cc1cccc(C(F)(F)F)c1)c1ccc2ccccc2c1.
What is the InChIKey of N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is DVISFRJQJFTZQH-CQSZACIVSA-N. The full InChI is InChI=1S/C21H18F3NO/c1-14(17-10-9-16-6-2-3-7-18(16)13-17)25-20(26)12-15-5-4-8-19(11-15)21(22,23)24/h2-11,13-14H,12H2,1H3,(H,25,26)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide?
N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 357.38 g/mol, XLogP of 5.28, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-naphthalen-2-ylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 8025350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).