3-Pyridinecarboxylic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, 2-(4-morpholinyl)ethyl ester, hydrochloride (1:1)
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Basic information
- CAS
23476-71-3- Standard SMILES
Cl.O=C(OCCN1CCOCC1)c1cccnc1Nc1cccc(C(F)(F)F)c1- InChIKey
FYBLYUCJZSTSKR-UHFFFAOYSA-N- Molecular formula
- C19H21ClF3N3O3
- Average molar mass
- 431.8 g/mol
- Monoisotopic mass
- 431.1223537
Names & identifiers
- Preferred name
- 3-Pyridinecarboxylic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, 2-(4-morpholinyl)ethyl ester, hydrochloride (1:1)
- IUPAC
- 2-morpholin-4-ylethyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate;hydrochloride
- English name
- 2-morpholinoethyl 2-(alpha,alpha,alpha-trifluoro-m-toluidino)nicotinate monohydrochloride
- Molecular formula
- C19H21ClF3N3O3
- Molecular weight
- 431.8365496
Names & synonyms
23476-71-32-Morpholinoethyl 2-(alpha,alpha,alpha-trifluoro-m-toluidino)nicotinate monohydrochlorideDTXSID609461573-Pyridinecarboxylic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, 2-(4-morpholinyl)ethyl ester, hydrochloride (1:1)3-Pyridinecarboxylic acid, 2-[[3-(trifluoromethyl)phenyl]amino]-, 2-(4-morpholinyl)ethyl ester, hydrochloride (1:1)RefChem:1068691DTXCID101374449245-680-1Morniflumate hydrochlorideMorniflumate HClNiflumic acid, beta-morpholinoethyl ester hydrochloride86827-84-1
Show more names
SCHEMBL10435533FYBLYUCJZSTSKR-UHFFFAOYSA-NEINECS 245-680-13-Pyridinecarboxylic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, 2-(4-morpholinyl)ethyl ester, monohydrochlorideNS000510602-(Morpholin-4-yl)ethyl 2-[3-(trifluoromethyl)anilino]pyridine-3-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 501
Related reactions
0 records
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Compound notes
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