N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide

C18H19F3N2O2 — CID 38435524

IUPACN-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESCN(C)Cc1ccccc1NC(=O)COc1ccccc1C(F)(F)F
InChIInChI=1S/C18H19F3N2O2/c1-23(2)11-13-7-3-5-9-15(13)22-17(24)12-25-16-10-6-4-8-14(16)18(19,20)21/h3-10H,11-12H2,1-2H3,(H,22,24)
InChIKeyZGFCXABEQLXRGE-UHFFFAOYSA-N
MW352.36 g/mol
LogP3.78
Rot. Bonds6

About N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide

N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide (PubChem CID 38435524) has the molecular formula C18H19F3N2O2 and a molecular weight of 352.36 g/mol. Its IUPAC name is N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
PubChem CID38435524
Molecular FormulaC18H19F3N2O2
Molecular Weight352.36 g/mol
Exact Mass352.14
IUPAC NameN-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESCN(C)Cc1ccccc1NC(=O)COc1ccccc1C(F)(F)F
InChIInChI=1S/C18H19F3N2O2/c1-23(2)11-13-7-3-5-9-15(13)22-17(24)12-25-16-10-6-4-8-14(16)18(19,20)21/h3-10H,11-12H2,1-2H3,(H,22,24)
InChIKeyZGFCXABEQLXRGE-UHFFFAOYSA-N
XLogP3.78
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.36
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(dimethylamino)methyl]phenyl]-2-ethoxyacetamide
CID 60763631
N-[2-(trifluoromethyl)phenyl]-2-(2,4,5-trimethylphenoxy)acetamide
CID 112978103
methyl 2-hydroxy-3-[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]benzoate
CID 56543418
N-(2,5-difluorophenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39088986
[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 2-(2-tert-butylphenoxy)acetate
CID 8701075
2-(dimethylamino)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 21383101
N-(2-pyrrolidin-1-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39095289
N-(2-methoxy-5-methylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 51283496
2-amino-N-[2-[(dimethylamino)methyl]phenyl]acetamide
CID 43695681
N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 164545151
2-(4-tert-butylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 1185791
2-(3,5-dimethoxyphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 7713877

Frequently Asked Questions

What is the IUPAC name of N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide (CID 38435524) is N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide is CN(C)Cc1ccccc1NC(=O)COc1ccccc1C(F)(F)F.
What is the InChIKey of N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is ZGFCXABEQLXRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N2O2/c1-23(2)11-13-7-3-5-9-15(13)22-17(24)12-25-16-10-6-4-8-14(16)18(19,20)21/h3-10H,11-12H2,1-2H3,(H,22,24).
What are the key properties of N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide?
N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 352.36 g/mol, XLogP of 3.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 38435524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).