N-phenyl-2-(2,3,5-trifluoroanilino)acetamide

C14H11F3N2O — CID 62810251

IUPACN-phenyl-2-(2,3,5-trifluoroanilino)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1F)Nc1ccccc1
InChIInChI=1S/C14H11F3N2O/c15-9-6-11(16)14(17)12(7-9)18-8-13(20)19-10-4-2-1-3-5-10/h1-7,18H,8H2,(H,19,20)
InChIKeyBBMSYJFUGDNNQT-UHFFFAOYSA-N
MW280.25 g/mol
LogP3.15
Rot. Bonds4

About N-phenyl-2-(2,3,5-trifluoroanilino)acetamide

N-phenyl-2-(2,3,5-trifluoroanilino)acetamide (PubChem CID 62810251) has the molecular formula C14H11F3N2O and a molecular weight of 280.25 g/mol. Its IUPAC name is N-phenyl-2-(2,3,5-trifluoroanilino)acetamide.

Molecular Properties

Compound NameN-phenyl-2-(2,3,5-trifluoroanilino)acetamide
PubChem CID62810251
Molecular FormulaC14H11F3N2O
Molecular Weight280.25 g/mol
Exact Mass280.08
IUPAC NameN-phenyl-2-(2,3,5-trifluoroanilino)acetamide
SMILESO=C(CNc1cc(F)cc(F)c1F)Nc1ccccc1
InChIInChI=1S/C14H11F3N2O/c15-9-6-11(16)14(17)12(7-9)18-8-13(20)19-10-4-2-1-3-5-10/h1-7,18H,8H2,(H,19,20)
InChIKeyBBMSYJFUGDNNQT-UHFFFAOYSA-N
XLogP3.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

2-anilino-N-(3,4,5-trifluorophenyl)acetamide
CID 62811643
2-(4-bromo-2,5-difluoroanilino)-N-phenylacetamide
CID 103843092
2-(3-chloro-2-fluoroanilino)-N-phenylacetamide
CID 42070736
N-(3-chlorophenyl)-2-(2,3-difluoroanilino)acetamide
CID 47336969
2-anilino-N-(2-bromo-4,6-difluorophenyl)acetamide
CID 60703391
2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]benzoic acid
CID 71835143
N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide
CID 109010043
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732
2-(2,4-difluoroanilino)-N-(4-phenylmethoxyphenyl)acetamide
CID 109010754
N-butyl-2-(2,3,5-trifluoroanilino)acetamide
CID 55118024
N-(cyclopropylmethyl)-2-(2,3,5-trifluoroanilino)acetamide
CID 62810074
2-(naphthalen-1-ylamino)-N-phenylacetamide
CID 9082358

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-(2,3,5-trifluoroanilino)acetamide?
The IUPAC name of N-phenyl-2-(2,3,5-trifluoroanilino)acetamide (CID 62810251) is N-phenyl-2-(2,3,5-trifluoroanilino)acetamide.
What is the SMILES notation for N-phenyl-2-(2,3,5-trifluoroanilino)acetamide?
The canonical SMILES for N-phenyl-2-(2,3,5-trifluoroanilino)acetamide is O=C(CNc1cc(F)cc(F)c1F)Nc1ccccc1.
What is the InChIKey of N-phenyl-2-(2,3,5-trifluoroanilino)acetamide?
The InChIKey is BBMSYJFUGDNNQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N2O/c15-9-6-11(16)14(17)12(7-9)18-8-13(20)19-10-4-2-1-3-5-10/h1-7,18H,8H2,(H,19,20).
What are the key properties of N-phenyl-2-(2,3,5-trifluoroanilino)acetamide?
N-phenyl-2-(2,3,5-trifluoroanilino)acetamide has a molecular weight of 280.25 g/mol, XLogP of 3.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-2-(2,3,5-trifluoroanilino)acetamide is sourced from PubChem (CID 62810251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).