2-methyl-2-[2-(trifluoromethyl)anilino]propanamide

C11H13F3N2O — CID 62312755

IUPAC2-methyl-2-[2-(trifluoromethyl)anilino]propanamide
SMILESCC(C)(Nc1ccccc1C(F)(F)F)C(N)=O
InChIInChI=1S/C11H13F3N2O/c1-10(2,9(15)17)16-8-6-4-3-5-7(8)11(12,13)14/h3-6,16H,1-2H3,(H2,15,17)
InChIKeyFTYVKDSAQCSXHJ-UHFFFAOYSA-N
MW246.23 g/mol
LogP2.38
Rot. Bonds3

About 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide

2-methyl-2-[2-(trifluoromethyl)anilino]propanamide (PubChem CID 62312755) has the molecular formula C11H13F3N2O and a molecular weight of 246.23 g/mol. Its IUPAC name is 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide.

Molecular Properties

Compound Name2-methyl-2-[2-(trifluoromethyl)anilino]propanamide
PubChem CID62312755
Molecular FormulaC11H13F3N2O
Molecular Weight246.23 g/mol
Exact Mass246.10
IUPAC Name2-methyl-2-[2-(trifluoromethyl)anilino]propanamide
SMILESCC(C)(Nc1ccccc1C(F)(F)F)C(N)=O
InChIInChI=1S/C11H13F3N2O/c1-10(2,9(15)17)16-8-6-4-3-5-7(8)11(12,13)14/h3-6,16H,1-2H3,(H2,15,17)
InChIKeyFTYVKDSAQCSXHJ-UHFFFAOYSA-N
XLogP2.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(trifluoromethyl)anilino]urea
CID 141255172
2-methyl-2-(methylamino)-N-[2-(trifluoromethyl)phenyl]propanamide
CID 62834657
1-carbamothioyl-3-[2-(trifluoromethyl)phenyl]urea
CID 134125791
2-(2-ethylsulfonylanilino)-2-methylpropanamide
CID 61220775
N,N'-bis[2-(trifluoromethyl)phenyl]oxamide
CID 3696493
3-amino-3-hydroxyimino-N-[2-(trifluoromethyl)phenyl]propanamide
CID 57365498
2-[2-(trifluoromethyl)anilino]acetic acid
CID 21238931
2-(2-carbamothioyl-3-fluoroanilino)-2-methylpropanamide
CID 79519748
2,2-dimethyl-3-[2-(trifluoromethyl)anilino]propanoic acid
CID 79629024
2-[(2-amino-3-pyridinyl)amino]-2-methylpropanamide
CID 104540232
4-[3-[[2-(trifluoromethyl)phenyl]carbamoylamino]prop-1-ynyl]benzamide
CID 90553418
ethyl N-[1,1,1,3,3,3-hexafluoro-2-[2-(trifluoromethyl)anilino]propan-2-yl]carbamate
CID 2264269

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide?
The IUPAC name of 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide (CID 62312755) is 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide.
What is the SMILES notation for 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide?
The canonical SMILES for 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide is CC(C)(Nc1ccccc1C(F)(F)F)C(N)=O.
What is the InChIKey of 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide?
The InChIKey is FTYVKDSAQCSXHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O/c1-10(2,9(15)17)16-8-6-4-3-5-7(8)11(12,13)14/h3-6,16H,1-2H3,(H2,15,17).
What are the key properties of 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide?
2-methyl-2-[2-(trifluoromethyl)anilino]propanamide has a molecular weight of 246.23 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[2-(trifluoromethyl)anilino]propanamide is sourced from PubChem (CID 62312755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).