N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide

C19H19F3N2O2 — CID 68870970

IUPACN-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide
SMILESCCC(=O)NCC(=O)NC(c1ccccc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c1-2-16(25)23-12-17(26)24-18(13-6-4-3-5-7-13)14-8-10-15(11-9-14)19(20,21)22/h3-11,18H,2,12H2,1H3,(H,23,25)(H,24,26)
InChIKeyUAQKDAVTOUCZLK-UHFFFAOYSA-N
MW364.37 g/mol
LogP3.44
Rot. Bonds6

About N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide

N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide (PubChem CID 68870970) has the molecular formula C19H19F3N2O2 and a molecular weight of 364.37 g/mol. Its IUPAC name is N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide.

Molecular Properties

Compound NameN-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide
PubChem CID68870970
Molecular FormulaC19H19F3N2O2
Molecular Weight364.37 g/mol
Exact Mass364.14
IUPAC NameN-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide
SMILESCCC(=O)NCC(=O)NC(c1ccccc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C19H19F3N2O2/c1-2-16(25)23-12-17(26)24-18(13-6-4-3-5-7-13)14-8-10-15(11-9-14)19(20,21)22/h3-11,18H,2,12H2,1H3,(H,23,25)(H,24,26)
InChIKeyUAQKDAVTOUCZLK-UHFFFAOYSA-N
XLogP3.44
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.37
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]-3-phenylpropanamide
CID 59689158
1-benzhydryl-3-[4-(trifluoromethyl)phenyl]urea
CID 108867584
2-(benzhydrylamino)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 2451774
4-cyano-N-[2-oxo-2-[[phenyl-[3-(trifluoromethyl)phenyl]methyl]amino]ethyl]benzamide
CID 24900234
N-[2-oxo-2-(2-phenylpropylamino)ethyl]-4-(trifluoromethyl)benzamide
CID 42910697
N-(2,2-difluoro-1,2-diphenylethyl)propanamide
CID 134936951
N-benzhydryl-2-(2,2,2-trifluoroethoxy)acetamide
CID 86915357
3-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]ethyl]propanamide
CID 119949428
4-fluoro-N-[2-[[(3-fluorophenyl)-[3-(trifluoromethyl)phenyl]methyl]amino]-2-oxoethyl]benzamide;4-fluoro-N-[2-[[(4-methylphenyl)-[3-(trifluoromethyl)phenyl]methyl]amino]-2-oxoethyl]benzamide
CID 158545251
N-[2-oxo-2-[1-[3-(trifluoromethyl)phenyl]butylamino]ethyl]-2-phenylacetamide
CID 51134582
N-[(1-methylpyrrol-2-yl)-[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 101433345
N-benzhydryl-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 100758154

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide?
The IUPAC name of N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide (CID 68870970) is N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide.
What is the SMILES notation for N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide?
The canonical SMILES for N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide is CCC(=O)NCC(=O)NC(c1ccccc1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide?
The InChIKey is UAQKDAVTOUCZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F3N2O2/c1-2-16(25)23-12-17(26)24-18(13-6-4-3-5-7-13)14-8-10-15(11-9-14)19(20,21)22/h3-11,18H,2,12H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide?
N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide has a molecular weight of 364.37 g/mol, XLogP of 3.44, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[[phenyl-[4-(trifluoromethyl)phenyl]methyl]amino]ethyl]propanamide is sourced from PubChem (CID 68870970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).