2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide

C18H17F4N3O3 — CID 71927158

IUPAC2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
SMILESO=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C(c1ccccc1F)N1CCOCC1
InChIInChI=1S/C18H17F4N3O3/c19-13-4-2-1-3-12(13)15(25-5-7-28-8-6-25)17(27)24-14-9-11(18(20,21)22)10-23-16(14)26/h1-4,9-10,15H,5-8H2,(H,23,26)(H,24,27)
InChIKeyRLZWMJABLJZYDP-UHFFFAOYSA-N
MW399.34 g/mol
LogP2.54
Rot. Bonds4

About 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide

2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide (PubChem CID 71927158) has the molecular formula C18H17F4N3O3 and a molecular weight of 399.34 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
PubChem CID71927158
Molecular FormulaC18H17F4N3O3
Molecular Weight399.34 g/mol
Exact Mass399.12
IUPAC Name2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide
SMILESO=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C(c1ccccc1F)N1CCOCC1
InChIInChI=1S/C18H17F4N3O3/c19-13-4-2-1-3-12(13)15(25-5-7-28-8-6-25)17(27)24-14-9-11(18(20,21)22)10-23-16(14)26/h1-4,9-10,15H,5-8H2,(H,23,26)(H,24,27)
InChIKeyRLZWMJABLJZYDP-UHFFFAOYSA-N
XLogP2.54
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.34
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-2-morpholin-4-ylacetamide
CID 167824561
2-(2-fluorophenyl)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-morpholin-4-ylacetamide
CID 71927156
(2S)-2-(2-fluorophenyl)-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-morpholin-4-ylacetamide
CID 97079846
N-[3-(ethylaminomethyl)phenyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
CID 119438130
N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
CID 71871802
2-(2-fluorophenyl)-N-[2-(methylamino)propyl]-2-morpholin-4-ylacetamide
CID 120826501
3-amino-2-methyl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]-3-phenylpropanamide
CID 119399129
2-methyl-3-(methylamino)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]propanamide;hydrochloride
CID 119399140
N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]cyclopropanecarboxamide
CID 47137245
2-(2-fluorophenyl)-2-morpholin-4-yl-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
CID 119460909
3-(2-fluorophenyl)-2-morpholin-4-ylpropanoic acid
CID 82088132
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-fluorophenyl)-2-morpholin-4-ylacetamide
CID 71926685

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide (CID 71927158) is 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide is O=C(Nc1cc(C(F)(F)F)c[nH]c1=O)C(c1ccccc1F)N1CCOCC1.
What is the InChIKey of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
The InChIKey is RLZWMJABLJZYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F4N3O3/c19-13-4-2-1-3-12(13)15(25-5-7-28-8-6-25)17(27)24-14-9-11(18(20,21)22)10-23-16(14)26/h1-4,9-10,15H,5-8H2,(H,23,26)(H,24,27).
What are the key properties of 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide?
2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide has a molecular weight of 399.34 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-morpholin-4-yl-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide is sourced from PubChem (CID 71927158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).