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

C10H11F3N2O — CID 62815758

IUPACN,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESCN(C)C(=O)CNc1cc(F)c(F)cc1F
InChIInChI=1S/C10H11F3N2O/c1-15(2)10(16)5-14-9-4-7(12)6(11)3-8(9)13/h3-4,14H,5H2,1-2H3
InChIKeyNTCHNGVAHIPKQD-UHFFFAOYSA-N
MW232.20 g/mol
LogP1.60
Rot. Bonds3

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

N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide (PubChem CID 62815758) has the molecular formula C10H11F3N2O and a molecular weight of 232.20 g/mol. Its IUPAC name is N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide
PubChem CID62815758
Molecular FormulaC10H11F3N2O
Molecular Weight232.20 g/mol
Exact Mass232.08
IUPAC NameN,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESCN(C)C(=O)CNc1cc(F)c(F)cc1F
InChIInChI=1S/C10H11F3N2O/c1-15(2)10(16)5-14-9-4-7(12)6(11)3-8(9)13/h3-4,14H,5H2,1-2H3
InChIKeyNTCHNGVAHIPKQD-UHFFFAOYSA-N
XLogP1.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.20
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl 5-[[2-(dimethylamino)-2-oxoethyl]amino]-2,4-difluorobenzoate
CID 78860654
N-ethyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815913
2-(4-bromo-5-fluoro-2-nitroanilino)-N,N-dimethylacetamide
CID 66110858
2-(3,5-difluoro-2-nitroanilino)-N,N-dimethylacetamide
CID 115507715
2-[4-fluoro-2-(trifluoromethylsulfonyl)anilino]-N,N-dimethylacetamide
CID 62867932
2-(3-fluoro-2-nitroanilino)-N,N-dimethylacetamide
CID 60789586
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420
N-butyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815370
2,2-dimethyl-3-(2,4,5-trifluoroanilino)propanoic acid
CID 79624686
2-[4-chloro-2-(difluoromethoxy)anilino]-N,N-dimethylacetamide
CID 86791806
2-(5-chloro-2-methoxyanilino)-N,N-dimethylacetamide
CID 28578226
2-(5-chloro-2-fluoroanilino)-N-methyl-N-propan-2-ylacetamide
CID 43385741

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide?
The IUPAC name of N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide (CID 62815758) is N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide?
The canonical SMILES for N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide is CN(C)C(=O)CNc1cc(F)c(F)cc1F.
What is the InChIKey of N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide?
The InChIKey is NTCHNGVAHIPKQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2O/c1-15(2)10(16)5-14-9-4-7(12)6(11)3-8(9)13/h3-4,14H,5H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide?
N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide has a molecular weight of 232.20 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2,4,5-trifluoroanilino)acetamide is sourced from PubChem (CID 62815758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).