N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide

C21H17F3N2O — CID 161345978

IUPACN-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C21H17F3N2O/c22-21(23,24)16-6-4-5-15(13-16)14-20(27)26-19-11-9-18(10-12-19)25-17-7-2-1-3-8-17/h1-13,25H,14H2,(H,26,27)
InChIKeyVNHHUSXZDAJBQK-UHFFFAOYSA-N
MW370.37 g/mol
LogP5.63
Rot. Bonds5

About N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide

N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 161345978) has the molecular formula C21H17F3N2O and a molecular weight of 370.37 g/mol. Its IUPAC name is N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID161345978
Molecular FormulaC21H17F3N2O
Molecular Weight370.37 g/mol
Exact Mass370.13
IUPAC NameN-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESO=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc(Nc2ccccc2)cc1
InChIInChI=1S/C21H17F3N2O/c22-21(23,24)16-6-4-5-15(13-16)14-20(27)26-19-11-9-18(10-12-19)25-17-7-2-1-3-8-17/h1-13,25H,14H2,(H,26,27)
InChIKeyVNHHUSXZDAJBQK-UHFFFAOYSA-N
XLogP5.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.37
LogP ≤ 55.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-phenyldiazenylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 7927071
N-methyl-2-[4-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]phenyl]acetamide
CID 38402676
N-(4-propan-2-ylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 4848940
N-methyl-4-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]benzamide
CID 8700304
2-(3-ethylphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 123188980
2-phenoxy-N-[4-[3-(trifluoromethyl)anilino]phenyl]acetamide
CID 112988067
2-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]benzoic acid
CID 15574688
2-(3-aminophenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 28712241
2-chloro-5-[[2-[3-(trifluoromethyl)phenyl]acetyl]amino]benzamide
CID 39997581
N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 8716542
N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 55865488
N'-[3-(trifluoromethyl)phenyl]-N-[4-(trifluoromethyl)phenyl]propanediamide
CID 108956063

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide (CID 161345978) is N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide is O=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc(Nc2ccccc2)cc1.
What is the InChIKey of N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is VNHHUSXZDAJBQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F3N2O/c22-21(23,24)16-6-4-5-15(13-16)14-20(27)26-19-11-9-18(10-12-19)25-17-7-2-1-3-8-17/h1-13,25H,14H2,(H,26,27).
What are the key properties of N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide?
N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 370.37 g/mol, XLogP of 5.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)-2-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 161345978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).