N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide

C20H20F3NO2 — CID 149202431

IUPACN-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccccc1C(=O)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C20H20F3NO2/c1-2-3-11-19(26)24-17-10-5-4-9-16(17)18(25)13-14-7-6-8-15(12-14)20(21,22)23/h4-10,12H,2-3,11,13H2,1H3,(H,24,26)
InChIKeyXEYMKAFOPSROHZ-UHFFFAOYSA-N
MW363.38 g/mol
LogP5.26
Rot. Bonds7

About N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide

N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide (PubChem CID 149202431) has the molecular formula C20H20F3NO2 and a molecular weight of 363.38 g/mol. Its IUPAC name is N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide.

Molecular Properties

Compound NameN-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide
PubChem CID149202431
Molecular FormulaC20H20F3NO2
Molecular Weight363.38 g/mol
Exact Mass363.14
IUPAC NameN-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide
SMILESCCCCC(=O)Nc1ccccc1C(=O)Cc1cccc(C(F)(F)F)c1
InChIInChI=1S/C20H20F3NO2/c1-2-3-11-19(26)24-17-10-5-4-9-16(17)18(25)13-14-7-6-8-15(12-14)20(21,22)23/h4-10,12H,2-3,11,13H2,1H3,(H,24,26)
InChIKeyXEYMKAFOPSROHZ-UHFFFAOYSA-N
XLogP5.26
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.38
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]benzoic acid
CID 15574688
2,6-dimethoxy-N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]benzamide
CID 162047234
N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]-1,2-oxazole-5-carboxamide
CID 152924749
N-[2-(ethylaminomethyl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 119440376
N-[2-(ethylaminomethyl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide;hydrochloride
CID 119440375
[2-(2-carbamoylanilino)-2-oxoethyl] 2-[3-(trifluoromethyl)phenyl]acetate
CID 7767549
1-(2-iodophenyl)-2-[3-(trifluoromethyl)phenyl]ethanone
CID 114966369
N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]-3H-indole-4-carboxamide
CID 149040508
N-[3-(trifluoromethyl)phenyl]hexanamide
CID 4609508
N-[2-(4-phenylbutanoyl)phenyl]-3-(trifluoromethyl)benzamide
CID 147729702
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 90626295
N-(2,3-dibromophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 67184957

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide?
The IUPAC name of N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide (CID 149202431) is N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide.
What is the SMILES notation for N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide?
The canonical SMILES for N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide is CCCCC(=O)Nc1ccccc1C(=O)Cc1cccc(C(F)(F)F)c1.
What is the InChIKey of N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide?
The InChIKey is XEYMKAFOPSROHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20F3NO2/c1-2-3-11-19(26)24-17-10-5-4-9-16(17)18(25)13-14-7-6-8-15(12-14)20(21,22)23/h4-10,12H,2-3,11,13H2,1H3,(H,24,26).
What are the key properties of N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide?
N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide has a molecular weight of 363.38 g/mol, XLogP of 5.26, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]pentanamide is sourced from PubChem (CID 149202431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).