N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide

C20H23F3N2O2 — CID 55572578

IUPACN-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide
SMILESCC(c1ccccc1)N(C)C(=O)CN(C)Cc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C20H23F3N2O2/c1-15(17-7-5-4-6-8-17)25(3)19(26)14-24(2)13-16-9-11-18(12-10-16)27-20(21,22)23/h4-12,15H,13-14H2,1-3H3
InChIKeyWWPVQHHQFDQYJG-UHFFFAOYSA-N
MW380.41 g/mol
LogP4.24
Rot. Bonds7

About N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide

N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide (PubChem CID 55572578) has the molecular formula C20H23F3N2O2 and a molecular weight of 380.41 g/mol. Its IUPAC name is N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide
PubChem CID55572578
Molecular FormulaC20H23F3N2O2
Molecular Weight380.41 g/mol
Exact Mass380.17
IUPAC NameN-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide
SMILESCC(c1ccccc1)N(C)C(=O)CN(C)Cc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C20H23F3N2O2/c1-15(17-7-5-4-6-8-17)25(3)19(26)14-24(2)13-16-9-11-18(12-10-16)27-20(21,22)23/h4-12,15H,13-14H2,1-3H3
InChIKeyWWPVQHHQFDQYJG-UHFFFAOYSA-N
XLogP4.24
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.41
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]butan-2-ol
CID 111488549
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-methyl-N-(1-phenylethyl)acetamide
CID 78964844
N-methyl-N-[[4-(trifluoromethoxy)phenyl]methyl]benzamide
CID 52569662
N-[1-(4-fluorophenyl)ethyl]-2-[(3-fluorophenyl)methyl-methylamino]-N-methylacetamide
CID 86913404
N-[(4-methoxyphenyl)methyl]-N-methyl-2-[methyl-[[2-(trifluoromethoxy)phenyl]methyl]amino]acetamide
CID 78845785
N-cyclopropyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]acetamide
CID 51076389
2-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide
CID 134041772
2-[(2-chloro-5-hydroxyphenyl)methyl-methylamino]-N-methyl-N-(1-phenylethyl)acetamide
CID 139020948
N-(4-fluorophenyl)-2-[methyl-[2-[methyl-[(1R)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
CID 9348198
N-methyl-1-thiophen-2-yl-N-[[4-(trifluoromethoxy)phenyl]methyl]ethanamine
CID 134793831
[2-[methyl(1-phenylethyl)amino]-2-oxoethyl] 4-(hydroxymethyl)benzoate
CID 46810880
2-[[4-(difluoromethoxy)phenyl]methyl-methylamino]-N-phenyl-N-propan-2-ylacetamide
CID 55356680

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide?
The IUPAC name of N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide (CID 55572578) is N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide.
What is the SMILES notation for N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide?
The canonical SMILES for N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide is CC(c1ccccc1)N(C)C(=O)CN(C)Cc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide?
The InChIKey is WWPVQHHQFDQYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23F3N2O2/c1-15(17-7-5-4-6-8-17)25(3)19(26)14-24(2)13-16-9-11-18(12-10-16)27-20(21,22)23/h4-12,15H,13-14H2,1-3H3.
What are the key properties of N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide?
N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide has a molecular weight of 380.41 g/mol, XLogP of 4.24, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]amino]-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 55572578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).