Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid

C7H11F3N2O4 — CID 17845793

IUPACmorpholine-4-carboxamide;2,2,2-trifluoroacetic acid
SMILESC1COCCN1C(=O)N.C(=O)(C(F)(F)F)O
InChIInChI=1S/C5H10N2O2.C2HF3O2/c6-5(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h1-4H2,(H2,6,8);(H,6,7)
InChIKeyHMEPUEYUXWJUAT-UHFFFAOYSA-N
MW244.17 g/mol
LogP—
Rot. Bonds

About Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid

Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid (PubChem CID 17845793) has the molecular formula C7H11F3N2O4 and a molecular weight of 244.17 g/mol. Its IUPAC name is morpholine-4-carboxamide;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound NameMorpholine-4-carboxamide;2,2,2-trifluoroacetic acid
PubChem CID17845793
Molecular FormulaC7H11F3N2O4
Molecular Weight244.17 g/mol
Exact Mass244.07
IUPAC Namemorpholine-4-carboxamide;2,2,2-trifluoroacetic acid
SMILESC1COCCN1C(=O)N.C(=O)(C(F)(F)F)O
InChIInChI=1S/C5H10N2O2.C2HF3O2/c6-5(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h1-4H2,(H2,6,8);(H,6,7)
InChIKeyHMEPUEYUXWJUAT-UHFFFAOYSA-N
XLogP—
TPSA92.90 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms16
Complexity193

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-methyl-N-[2-(methylamino)ethyl]morpholine-4-carboxamide;2,2,2-trifluoroacetic acid
CID 67765031
CID 141083019
CID 141083019
2-[Morpholine-4-carbonyl(2,2,2-trifluoroethyl)amino]acetic acid
CID 79258225
2-Aminoacetic acid;morpholine-4-carboxamide
CID 19974430
Morpholine-4-carboxamide;oxalic acid
CID 21425360
2-Fluoropropanoic acid;morpholine-4-carboxamide
CID 89922516

Frequently Asked Questions

What is the IUPAC name of Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid?
The IUPAC name of Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid (CID 17845793) is morpholine-4-carboxamide;2,2,2-trifluoroacetic acid.
What is the SMILES notation for Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid?
The canonical SMILES for Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid is C1COCCN1C(=O)N.C(=O)(C(F)(F)F)O.
What is the InChIKey of Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid?
The InChIKey is HMEPUEYUXWJUAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2.C2HF3O2/c6-5(8)7-1-3-9-4-2-7;3-2(4,5)1(6)7/h1-4H2,(H2,6,8);(H,6,7).
What are the key properties of Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid?
Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid has a molecular weight of 244.17 g/mol, XLogP of not available, 0 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for Morpholine-4-carboxamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 17845793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).