N-ethyl-2-(2,4,5-trifluoroanilino)acetamide

C10H11F3N2O — CID 62815913

IUPACN-ethyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESCCNC(=O)CNc1cc(F)c(F)cc1F
InChIInChI=1S/C10H11F3N2O/c1-2-14-10(16)5-15-9-4-7(12)6(11)3-8(9)13/h3-4,15H,2,5H2,1H3,(H,14,16)
InChIKeyQCPGENKSPCZSFJ-UHFFFAOYSA-N
MW232.20 g/mol
LogP1.65
Rot. Bonds4

About N-ethyl-2-(2,4,5-trifluoroanilino)acetamide

N-ethyl-2-(2,4,5-trifluoroanilino)acetamide (PubChem CID 62815913) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is N-ethyl-2-(2,4,5-trifluoroanilino)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(2,4,5-trifluoroanilino)acetamide
PubChem CID62815913
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC NameN-ethyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESCCNC(=O)CNc1cc(F)c(F)cc1F
InChIInChI=1S/C10H11F3N2O/c1-2-14-10(16)5-15-9-4-7(12)6(11)3-8(9)13/h3-4,15H,2,5H2,1H3,(H,14,16)
InChIKeyQCPGENKSPCZSFJ-UHFFFAOYSA-N
XLogP1.65
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.65
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

N-butyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815370
N-benzyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815218
N-ethyl-2-(3,4,5-trifluoroanilino)acetamide
CID 62810089
2-(4-bromo-2,5-difluoroanilino)-N-propylacetamide
CID 103843113
N-ethyl-2-(2-fluoro-5-methoxy-4-nitroanilino)acetamide
CID 86802918
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420
N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815758
2-(4-bromo-5-fluoro-2-nitroanilino)-N-ethylacetamide
CID 66112618
2-(2-amino-5-fluoroanilino)-N-ethylacetamide
CID 62377991
2-(2-amino-4-fluoro-5-methoxyanilino)-N-ethylacetamide
CID 63600102
2-(4-carbamothioyl-2,6-difluoroanilino)-N-ethylacetamide
CID 81286351
N-(2,4,5-trifluorophenyl)propanamide
CID 63372836

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2,4,5-trifluoroanilino)acetamide?
The IUPAC name of N-ethyl-2-(2,4,5-trifluoroanilino)acetamide (CID 62815913) is N-ethyl-2-(2,4,5-trifluoroanilino)acetamide.
What is the SMILES notation for N-ethyl-2-(2,4,5-trifluoroanilino)acetamide?
The canonical SMILES for N-ethyl-2-(2,4,5-trifluoroanilino)acetamide is CCNC(=O)CNc1cc(F)c(F)cc1F.
What is the InChIKey of N-ethyl-2-(2,4,5-trifluoroanilino)acetamide?
The InChIKey is QCPGENKSPCZSFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c1-2-14-10(16)5-15-9-4-7(12)6(11)3-8(9)13/h3-4,15H,2,5H2,1H3,(H,14,16).
What are the key properties of N-ethyl-2-(2,4,5-trifluoroanilino)acetamide?
N-ethyl-2-(2,4,5-trifluoroanilino)acetamide has a molecular weight of 232.20 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2,4,5-trifluoroanilino)acetamide is sourced from PubChem (CID 62815913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).