2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide

C20H16F3NO3 — CID 133168907

IUPAC2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide
SMILESCC(Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C20H16F3NO3/c1-13(26-18-9-6-14-4-2-3-5-15(14)12-18)19(25)24-16-7-10-17(11-8-16)27-20(21,22)23/h2-13H,1H3,(H,24,25)
InChIKeyVTNNSRJMTWHTRM-UHFFFAOYSA-N
MW375.35 g/mol
LogP5.14
Rot. Bonds5

About 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide

2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide (PubChem CID 133168907) has the molecular formula C20H16F3NO3 and a molecular weight of 375.35 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide
PubChem CID133168907
Molecular FormulaC20H16F3NO3
Molecular Weight375.35 g/mol
Exact Mass375.11
IUPAC Name2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide
SMILESCC(Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C20H16F3NO3/c1-13(26-18-9-6-14-4-2-3-5-15(14)12-18)19(25)24-16-7-10-17(11-8-16)27-20(21,22)23/h2-13H,1H3,(H,24,25)
InChIKeyVTNNSRJMTWHTRM-UHFFFAOYSA-N
XLogP5.14
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.35
LogP ≤ 55.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-phenoxy-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 934380
2-(3,4-dimethylphenoxy)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 133166592
2-(2-methylphenoxy)-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 133166532
(2R)-2-(4-fluorophenoxy)-N-naphthalen-2-ylpropanamide
CID 887383
(2S)-N-(3-acetamidophenyl)-2-naphthalen-2-yloxypropanamide
CID 42561585
(2R)-2-(4-methylphenoxy)-N-naphthalen-2-ylpropanamide
CID 837371
(2R)-N-methyl-2-naphthalen-2-yloxypropanamide
CID 42561231
(2R)-N-(4-fluorophenyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 7652623
(2S)-N-(4-fluorophenyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
CID 7652621
2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 1370829
(2S)-2-chloro-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 2304863
(2S)-N-[4-(4-methylpiperazin-1-yl)phenyl]-2-naphthalen-2-yloxypropanamide
CID 99131039

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide (CID 133168907) is 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide is CC(Oc1ccc2ccccc2c1)C(=O)Nc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide?
The InChIKey is VTNNSRJMTWHTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3NO3/c1-13(26-18-9-6-14-4-2-3-5-15(14)12-18)19(25)24-16-7-10-17(11-8-16)27-20(21,22)23/h2-13H,1H3,(H,24,25).
What are the key properties of 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide?
2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide has a molecular weight of 375.35 g/mol, XLogP of 5.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-[4-(trifluoromethoxy)phenyl]propanamide is sourced from PubChem (CID 133168907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).