N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide

C14H19F3N2O — CID 107493677

IUPACN-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)(C(=O)N(CCN)CC(F)(F)F)c1ccccc1
InChIInChI=1S/C14H19F3N2O/c1-13(2,11-6-4-3-5-7-11)12(20)19(9-8-18)10-14(15,16)17/h3-7H,8-10,18H2,1-2H3
InChIKeyOSWBTPQGIAEERF-UHFFFAOYSA-N
MW288.31 g/mol
LogP2.31
Rot. Bonds5

About N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide

N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 107493677) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID107493677
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC NameN-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)(C(=O)N(CCN)CC(F)(F)F)c1ccccc1
InChIInChI=1S/C14H19F3N2O/c1-13(2,11-6-4-3-5-7-11)12(20)19(9-8-18)10-14(15,16)17/h3-7H,8-10,18H2,1-2H3
InChIKeyOSWBTPQGIAEERF-UHFFFAOYSA-N
XLogP2.31
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 107492581
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-2-methyl-2-phenylpropanamide
CID 79668566
N-(2-aminoethyl)-3-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 107493544
2-amino-N-(2-methylpropyl)-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide
CID 62488944
N-(2-aminoethyl)-1-phenyl-N-(2,2,2-trifluoroethyl)cyclopropane-1-carboxamide
CID 107493531
N-(2-aminoethyl)-2,2-difluoro-2-phenyl-N-(2-phenylethyl)acetamide
CID 120885258
N-(2-aminoethyl)-3-hydroxy-2-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 107493496
N-(3-aminopropyl)-N-cyclopentyl-2-methyl-2-phenylpropanamide
CID 43136808
N-(cyanomethyl)-2-methyl-2-phenyl-N-propylpropanamide
CID 61224496
2-methyl-2-phenyl-3-[propyl(2,2,2-trifluoroethyl)amino]propanoic acid
CID 62272876
N,2-dimethyl-2-phenyl-N-silylpropanamide
CID 173360182
N-(2-aminoethyl)-2-fluoro-5-methyl-N-(2,2,2-trifluoroethyl)benzamide
CID 107493456

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide (CID 107493677) is N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide is CC(C)(C(=O)N(CCN)CC(F)(F)F)c1ccccc1.
What is the InChIKey of N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is OSWBTPQGIAEERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c1-13(2,11-6-4-3-5-7-11)12(20)19(9-8-18)10-14(15,16)17/h3-7H,8-10,18H2,1-2H3.
What are the key properties of N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide?
N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 288.31 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-methyl-2-phenyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 107493677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).