N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide

C11H13F3N2O2 — CID 28595958

IUPACN-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCOc1ccccc1NC(=O)CNCC(F)(F)F
InChIInChI=1S/C11H13F3N2O2/c1-18-9-5-3-2-4-8(9)16-10(17)6-15-7-11(12,13)14/h2-5,15H,6-7H2,1H3,(H,16,17)
InChIKeyPPKFLVCYHRWEOM-UHFFFAOYSA-N
MW262.23 g/mol
LogP1.79
Rot. Bonds5

About N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide

N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 28595958) has the molecular formula C11H13F3N2O2 and a molecular weight of 262.23 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID28595958
Molecular FormulaC11H13F3N2O2
Molecular Weight262.23 g/mol
Exact Mass262.09
IUPAC NameN-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESCOc1ccccc1NC(=O)CNCC(F)(F)F
InChIInChI=1S/C11H13F3N2O2/c1-18-9-5-3-2-4-8(9)16-10(17)6-15-7-11(12,13)14/h2-5,15H,6-7H2,1H3,(H,16,17)
InChIKeyPPKFLVCYHRWEOM-UHFFFAOYSA-N
XLogP1.79
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxy-4-methylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78958038
N-(2-methoxyphenyl)-2-[(2-methyl-2-methylsulfonylpropyl)amino]acetamide
CID 79562333
4,4,4-trifluoro-N-(2-methoxyphenyl)butanamide
CID 155941258
N-(2-methoxyphenyl)-2-[2-(trifluoromethylsulfanyl)ethylamino]acetamide
CID 106429534
N-(2-tert-butylphenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78914752
N-(2-methoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 9322485
N-(2-bromophenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 28595976
N-methyl-2-[[2-(2,2,2-trifluoroethylamino)acetyl]amino]benzamide
CID 78957981
2-[[2-(2-methoxyanilino)-2-oxoethyl]disulfanyl]-N-(2-methoxyphenyl)acetamide
CID 2346844
4-[[2-(2-methoxyanilino)-2-oxoethyl]amino]butanamide
CID 60864309
2-[(4-hydroxyphenyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 114331761
N-(2-ethoxy-4-fluorophenyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 78957990

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 28595958) is N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide is COc1ccccc1NC(=O)CNCC(F)(F)F.
What is the InChIKey of N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is PPKFLVCYHRWEOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O2/c1-18-9-5-3-2-4-8(9)16-10(17)6-15-7-11(12,13)14/h2-5,15H,6-7H2,1H3,(H,16,17).
What are the key properties of N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide?
N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 262.23 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 28595958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).