N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide

C17H15F4NO2 — CID 166193053

IUPACN-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESCN(Cc1cccc(F)c1)C(=O)C(O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C17H15F4NO2/c1-22(10-11-4-2-7-14(18)8-11)16(24)15(23)12-5-3-6-13(9-12)17(19,20)21/h2-9,15,23H,10H2,1H3
InChIKeyQIJPCQVTMHJNFJ-UHFFFAOYSA-N
MW341.30 g/mol
LogP3.54
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide

N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide (PubChem CID 166193053) has the molecular formula C17H15F4NO2 and a molecular weight of 341.30 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide
PubChem CID166193053
Molecular FormulaC17H15F4NO2
Molecular Weight341.30 g/mol
Exact Mass341.10
IUPAC NameN-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide
SMILESCN(Cc1cccc(F)c1)C(=O)C(O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C17H15F4NO2/c1-22(10-11-4-2-7-14(18)8-11)16(24)15(23)12-5-3-6-13(9-12)17(19,20)21/h2-9,15,23H,10H2,1H3
InChIKeyQIJPCQVTMHJNFJ-UHFFFAOYSA-N
XLogP3.54
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.30
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-fluorophenyl)methyl]-N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanamide
CID 112768441
2,2-difluoro-N-[(3-fluorophenyl)methyl]-N-methylacetamide
CID 103600519
[1-[(3-fluorophenyl)methyl-methylamino]-1-oxopropan-2-yl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate
CID 43028147
2-amino-3-[(3-fluorophenyl)methyl-methylamino]-3-oxopropanoic acid
CID 115179409
2-amino-N-[(3-fluorophenyl)methyl]-N,3-dimethylbutanamide
CID 43211988
N-[(3-fluorophenyl)methyl]-N-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetamide
CID 78781511
2-[ethyl(methyl)amino]-N-[(3-fluorophenyl)methyl]-N-methylpropanamide
CID 60516816
3-[(3-fluorophenyl)methyl-methylamino]-2-(methylamino)-3-oxopropanoic acid
CID 115189481
(2S)-2-amino-N-[(3-fluorophenyl)methyl]-N-methyl-3-phenylpropanamide
CID 28802517
2-amino-N-[(3-fluorophenyl)methyl]-N-methyl-3-phenylpropanamide
CID 43211990
2-ethoxy-N-[(3-fluorophenyl)methyl]-N-methylpropanamide
CID 86985470
acetic acid;N-benzyl-2-hydroxy-N-methyl-2-phenylacetamide
CID 67863072

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide (CID 166193053) is N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide is CN(Cc1cccc(F)c1)C(=O)C(O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is QIJPCQVTMHJNFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F4NO2/c1-22(10-11-4-2-7-14(18)8-11)16(24)15(23)12-5-3-6-13(9-12)17(19,20)21/h2-9,15,23H,10H2,1H3.
What are the key properties of N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide?
N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 341.30 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-2-hydroxy-N-methyl-2-[3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 166193053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).