N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide

C13H15F3N2O2 — CID 891590

IUPACN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
InChIInChI=1S/C13H15F3N2O2/c1-9(19)17-11-8-10(13(14,15)16)2-3-12(11)18-4-6-20-7-5-18/h2-3,8H,4-7H2,1H3,(H,17,19)
InChIKeyZGDGDOSPJHNBOF-UHFFFAOYSA-N
MW288.27 g/mol
LogP2.50
Rot. Bonds2

About N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide

N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide (PubChem CID 891590) has the molecular formula C13H15F3N2O2 and a molecular weight of 288.27 g/mol. Its IUPAC name is N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide
PubChem CID891590
Molecular FormulaC13H15F3N2O2
Molecular Weight288.27 g/mol
Exact Mass288.11
IUPAC NameN-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1
InChIInChI=1S/C13H15F3N2O2/c1-9(19)17-11-8-10(13(14,15)16)2-3-12(11)18-4-6-20-7-5-18/h2-3,8H,4-7H2,1H3,(H,17,19)
InChIKeyZGDGDOSPJHNBOF-UHFFFAOYSA-N
XLogP2.50
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.27
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-Amino-4-(trifluoromethyl)phenyl)morpholine
CID 136624
2-(4-Methylpiperazin-1-yl)-5-(trifluoromethyl)aniline
CID 693288
2'-Amino-4'-trifluoromethylacetanilide
CID 2779452
7-(Trifluoromethyl)-1,2,3,4-tetrahydroquinoxalin-2-one
CID 5311897
N-(3,4-dimethylphenyl)-3-morpholin-4-ylpropanamide
CID 740682
3-fluoro-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]benzamide
CID 1086047
4-Morpholineacetamide, N-(2-methylphenyl)-, monohydrochloride
CID 2827840
N-(4-((morpholin-4-yl)methyl)phenyl)acetamide
CID 783020
N-(2,3-dimethylphenyl)-2-morpholin-4-ylacetamide
CID 755358
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]butanamide
CID 698316
N-(3,4-dimethylphenyl)-2-morpholin-4-ylacetamide
CID 856321
N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]propanamide
CID 953311

Frequently Asked Questions

What is the IUPAC name of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide (CID 891590) is N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide is CC(=O)Nc1cc(C(F)(F)F)ccc1N1CCOCC1.
What is the InChIKey of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide?
The InChIKey is ZGDGDOSPJHNBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O2/c1-9(19)17-11-8-10(13(14,15)16)2-3-12(11)18-4-6-20-7-5-18/h2-3,8H,4-7H2,1H3,(H,17,19).
What are the key properties of N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide?
N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide has a molecular weight of 288.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 891590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).