2-morpholin-4-yl-5-(trifluoromethyl)benzamide

C12H13F3N2O2 — CID 69272412

IUPAC2-morpholin-4-yl-5-(trifluoromethyl)benzamide
SMILESNC(=O)c1cc(C(F)(F)F)ccc1N1CCOCC1
InChIInChI=1S/C12H13F3N2O2/c13-12(14,15)8-1-2-10(9(7-8)11(16)18)17-3-5-19-6-4-17/h1-2,7H,3-6H2,(H2,16,18)
InChIKeyMYVSNSPGWJUOTN-UHFFFAOYSA-N
MW274.24 g/mol
LogP1.64
Rot. Bonds2

About 2-morpholin-4-yl-5-(trifluoromethyl)benzamide

2-morpholin-4-yl-5-(trifluoromethyl)benzamide (PubChem CID 69272412) has the molecular formula C12H13F3N2O2 and a molecular weight of 274.24 g/mol. Its IUPAC name is 2-morpholin-4-yl-5-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2-morpholin-4-yl-5-(trifluoromethyl)benzamide
PubChem CID69272412
Molecular FormulaC12H13F3N2O2
Molecular Weight274.24 g/mol
Exact Mass274.09
IUPAC Name2-morpholin-4-yl-5-(trifluoromethyl)benzamide
SMILESNC(=O)c1cc(C(F)(F)F)ccc1N1CCOCC1
InChIInChI=1S/C12H13F3N2O2/c13-12(14,15)8-1-2-10(9(7-8)11(16)18)17-3-5-19-6-4-17/h1-2,7H,3-6H2,(H2,16,18)
InChIKeyMYVSNSPGWJUOTN-UHFFFAOYSA-N
XLogP1.64
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.24
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-thiomorpholin-4-yl-5-(trifluoromethyl)benzamide
CID 152584418
ethyl 2-morpholin-4-yl-4-(trifluoromethyl)benzoate
CID 126483070
N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]carbamothioyl]acetamide
CID 851473
4-morpholin-4-yl-3-[6-(trifluoromethyl)-1,3-benzothiazol-2-yl]benzamide
CID 150035010
2-(2,2-dimethylpiperazin-1-yl)-5-(trifluoromethyl)benzamide
CID 65462817
1-tert-butyl-3-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]urea
CID 78786583
4-chloro-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]benzamide
CID 2121780
2-(4,4-dimethylpiperidin-1-yl)-5-(trifluoromethyl)benzenecarbothioamide
CID 62932311
[4-[2-fluoro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-(5-methyl-2-morpholin-4-ylphenyl)methanone;formaldehyde;methanol
CID 143013253
trans-(1R,2R)-2-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 26873317
2-methyl-N-[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]butanamide
CID 51331092
5-(trifluoromethyl)-2-[(3S)-3-[[5-(trifluoromethyl)-2-pyridinyl]oxy]pyrrolidin-1-yl]benzamide
CID 156814447

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-5-(trifluoromethyl)benzamide?
The IUPAC name of 2-morpholin-4-yl-5-(trifluoromethyl)benzamide (CID 69272412) is 2-morpholin-4-yl-5-(trifluoromethyl)benzamide.
What is the SMILES notation for 2-morpholin-4-yl-5-(trifluoromethyl)benzamide?
The canonical SMILES for 2-morpholin-4-yl-5-(trifluoromethyl)benzamide is NC(=O)c1cc(C(F)(F)F)ccc1N1CCOCC1.
What is the InChIKey of 2-morpholin-4-yl-5-(trifluoromethyl)benzamide?
The InChIKey is MYVSNSPGWJUOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13F3N2O2/c13-12(14,15)8-1-2-10(9(7-8)11(16)18)17-3-5-19-6-4-17/h1-2,7H,3-6H2,(H2,16,18).
What are the key properties of 2-morpholin-4-yl-5-(trifluoromethyl)benzamide?
2-morpholin-4-yl-5-(trifluoromethyl)benzamide has a molecular weight of 274.24 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 69272412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).