2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide

C20H15F4N3O — CID 113034872

IUPAC2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(Nc2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C20H15F4N3O/c21-15-6-4-13(5-7-15)10-19(28)27-18-9-8-17(12-25-18)26-16-3-1-2-14(11-16)20(22,23)24/h1-9,11-12,26H,10H2,(H,25,27,28)
InChIKeySTULEYSFMZQXSV-UHFFFAOYSA-N
MW389.35 g/mol
LogP5.16
Rot. Bonds5

About 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide

2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide (PubChem CID 113034872) has the molecular formula C20H15F4N3O and a molecular weight of 389.35 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide
PubChem CID113034872
Molecular FormulaC20H15F4N3O
Molecular Weight389.35 g/mol
Exact Mass389.12
IUPAC Name2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1ccc(Nc2cccc(C(F)(F)F)c2)cn1
InChIInChI=1S/C20H15F4N3O/c21-15-6-4-13(5-7-15)10-19(28)27-18-9-8-17(12-25-18)26-16-3-1-2-14(11-16)20(22,23)24/h1-9,11-12,26H,10H2,(H,25,27,28)
InChIKeySTULEYSFMZQXSV-UHFFFAOYSA-N
XLogP5.16
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.35
LogP ≤ 55.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide
CID 113034847
methyl 3-[[6-[[2-(4-fluorophenyl)acetyl]amino]-3-pyridinyl]amino]benzoate
CID 113035333
N-[5-(2,6-dimethylanilino)-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113032265
N-[5-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113036236
2-(3-fluorophenyl)-N-[5-(3-methylanilino)-2-pyridinyl]acetamide
CID 113031460
5-(3-fluoroanilino)-N-[3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109200292
N-[5-(4-ethylanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113032512
2,2-dimethyl-N-[6-[3-(trifluoromethyl)anilino]-3-pyridinyl]propanamide
CID 110178309
N-(4-fluorophenyl)-2-[3-(trifluoromethyl)anilino]pyrimidine-5-carboxamide
CID 109268482
N-[5-(4-acetamidoanilino)-2-pyridinyl]-2-(3-fluorophenyl)acetamide
CID 113035220
N-[6-(tert-butylamino)-3-pyridinyl]-2-(4-fluorophenyl)acetamide
CID 113014791
2-(4-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]acetamide
CID 2666418

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide?
The IUPAC name of 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide (CID 113034872) is 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide is O=C(Cc1ccc(F)cc1)Nc1ccc(Nc2cccc(C(F)(F)F)c2)cn1.
What is the InChIKey of 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide?
The InChIKey is STULEYSFMZQXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F4N3O/c21-15-6-4-13(5-7-15)10-19(28)27-18-9-8-17(12-25-18)26-16-3-1-2-14(11-16)20(22,23)24/h1-9,11-12,26H,10H2,(H,25,27,28).
What are the key properties of 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide?
2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide has a molecular weight of 389.35 g/mol, XLogP of 5.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-[5-[3-(trifluoromethyl)anilino]-2-pyridinyl]acetamide is sourced from PubChem (CID 113034872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).