N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide

C19H20F3NO2 — CID 100758798

IUPACN-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESCC(C)(Cc1ccccc1)NC(=O)COc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H20F3NO2/c1-18(2,12-14-7-4-3-5-8-14)23-17(24)13-25-16-10-6-9-15(11-16)19(20,21)22/h3-11H,12-13H2,1-2H3,(H,23,24)
InChIKeyVBGRXSXDCHHLLR-UHFFFAOYSA-N
MW351.37 g/mol
LogP4.22
Rot. Bonds6

About N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide

N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide (PubChem CID 100758798) has the molecular formula C19H20F3NO2 and a molecular weight of 351.37 g/mol. Its IUPAC name is N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide
PubChem CID100758798
Molecular FormulaC19H20F3NO2
Molecular Weight351.37 g/mol
Exact Mass351.14
IUPAC NameN-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide
SMILESCC(C)(Cc1ccccc1)NC(=O)COc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H20F3NO2/c1-18(2,12-14-7-4-3-5-8-14)23-17(24)13-25-16-10-6-9-15(11-16)19(20,21)22/h3-11H,12-13H2,1-2H3,(H,23,24)
InChIKeyVBGRXSXDCHHLLR-UHFFFAOYSA-N
XLogP4.22
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.37
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenoxy)-N-(2-methyl-1-phenylpropan-2-yl)acetamide
CID 84568280
N-[(2R)-4-methyl-4-phenylpentan-2-yl]-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100758350
N-benzhydryl-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100758154
2-phenoxy-N-[4-[3-(trifluoromethyl)phenoxy]but-2-ynyl]acetamide
CID 90575880
N-(3-ethylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 34280640
1-[3-(trifluoromethyl)phenoxy]propan-2-one
CID 14574936
N-tert-butyl-2-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 100758130
2-[3-(trifluoromethyl)phenoxy]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100757803
(2S)-4-methyl-2-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]pentanoic acid
CID 119361630
2-(4-iodophenoxy)-N'-[2-[3-(trifluoromethyl)phenoxy]acetyl]acetohydrazide
CID 4844211
2,2-dimethyl-N-[2-phenyl-1,1-bis[3-(trifluoromethyl)phenyl]ethyl]propanamide
CID 59459518
N,N-dimethyl-2-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]acetamide
CID 9480621

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide (CID 100758798) is N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide is CC(C)(Cc1ccccc1)NC(=O)COc1cccc(C(F)(F)F)c1.
What is the InChIKey of N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is VBGRXSXDCHHLLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F3NO2/c1-18(2,12-14-7-4-3-5-8-14)23-17(24)13-25-16-10-6-9-15(11-16)19(20,21)22/h3-11H,12-13H2,1-2H3,(H,23,24).
What are the key properties of N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide?
N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 351.37 g/mol, XLogP of 4.22, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-phenylpropan-2-yl)-2-[3-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 100758798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).