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

C15H12F4N2O — CID 109009674

IUPACN-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide
SMILESO=C(CNc1ccccc1C(F)(F)F)Nc1cccc(F)c1
InChIInChI=1S/C15H12F4N2O/c16-10-4-3-5-11(8-10)21-14(22)9-20-13-7-2-1-6-12(13)15(17,18)19/h1-8,20H,9H2,(H,21,22)
InChIKeyORWLSALJJBVZLH-UHFFFAOYSA-N
MW312.27 g/mol
LogP3.90
Rot. Bonds4

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

N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide (PubChem CID 109009674) has the molecular formula C15H12F4N2O and a molecular weight of 312.27 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide
PubChem CID109009674
Molecular FormulaC15H12F4N2O
Molecular Weight312.27 g/mol
Exact Mass312.09
IUPAC NameN-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide
SMILESO=C(CNc1ccccc1C(F)(F)F)Nc1cccc(F)c1
InChIInChI=1S/C15H12F4N2O/c16-10-4-3-5-11(8-10)21-14(22)9-20-13-7-2-1-6-12(13)15(17,18)19/h1-8,20H,9H2,(H,21,22)
InChIKeyORWLSALJJBVZLH-UHFFFAOYSA-N
XLogP3.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.27
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-chloro-2-(trifluoromethyl)anilino]-N-(3-fluorophenyl)acetamide
CID 109010763
2-[4-acetamido-2-(trifluoromethyl)anilino]-N-(3-fluorophenyl)acetamide
CID 31418097
2-(2-ethylanilino)-N-(3-fluorophenyl)acetamide
CID 9105176
2-[2-[[2-(3-fluoroanilino)-2-oxoethyl]amino]phenyl]-N,N-dimethylacetamide
CID 47077664
2-[2-(dimethylamino)anilino]-N-(3-fluorophenyl)acetamide
CID 106759867
N-(3-fluorophenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 29046314
2-[4-chloro-2-(trifluoromethyl)anilino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 109009727
2-(4-chloro-2-methylanilino)-N-(3-fluorophenyl)acetamide
CID 26507132
N-(3-fluorophenyl)-2-(trifluoromethyl)benzamide
CID 139177364
N-(3-bromophenyl)-3-[2-(trifluoromethyl)anilino]propanamide
CID 109040694
2-(3,3-dimethylbutan-2-ylamino)-N-(3-fluorophenyl)acetamide
CID 115626967
2-(3-fluoroanilino)-N-(2-iodophenyl)acetamide
CID 26506350

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide (CID 109009674) is N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide is O=C(CNc1ccccc1C(F)(F)F)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide?
The InChIKey is ORWLSALJJBVZLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F4N2O/c16-10-4-3-5-11(8-10)21-14(22)9-20-13-7-2-1-6-12(13)15(17,18)19/h1-8,20H,9H2,(H,21,22).
What are the key properties of N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide?
N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide has a molecular weight of 312.27 g/mol, XLogP of 3.90, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-[2-(trifluoromethyl)anilino]acetamide is sourced from PubChem (CID 109009674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).