4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one

C16H16F3N3O2 — CID 130344638

IUPAC4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one
SMILESC[C@@H]1COCCN1c1cc(-c2cccnc2C(F)(F)F)[nH]c(=O)c1
InChIInChI=1S/C16H16F3N3O2/c1-10-9-24-6-5-22(10)11-7-13(21-14(23)8-11)12-3-2-4-20-15(12)16(17,18)19/h2-4,7-8,10H,5-6,9H2,1H3,(H,21,23)/t10-/m1/s1
InChIKeyNIYLGOFXXWDGHE-SNVBAGLBSA-N
MW339.32 g/mol
LogP2.68
Rot. Bonds2

About 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one

4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one (PubChem CID 130344638) has the molecular formula C16H16F3N3O2 and a molecular weight of 339.32 g/mol. Its IUPAC name is 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one
PubChem CID130344638
Molecular FormulaC16H16F3N3O2
Molecular Weight339.32 g/mol
Exact Mass339.12
IUPAC Name4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one
SMILESC[C@@H]1COCCN1c1cc(-c2cccnc2C(F)(F)F)[nH]c(=O)c1
InChIInChI=1S/C16H16F3N3O2/c1-10-9-24-6-5-22(10)11-7-13(21-14(23)8-11)12-3-2-4-20-15(12)16(17,18)19/h2-4,7-8,10H,5-6,9H2,1H3,(H,21,23)/t10-/m1/s1
InChIKeyNIYLGOFXXWDGHE-SNVBAGLBSA-N
XLogP2.68
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-methylmorpholin-4-yl)-6-[3-(trifluoromethyl)morpholin-4-yl]-1H-pyridin-2-one
CID 130359931
4-(3-methylmorpholin-4-yl)-6-(2-pyridin-2-ylpyrrolidin-1-yl)-1H-pyridin-2-one
CID 130359366
(3R)-4-[3-hydroxy-7-[2-(trifluoromethyl)-3-pyridinyl]-2H-[1,3]thiazolo[4,5-b]pyridin-5-yl]-3-methylmorpholine
CID 169061186
4-[(3R)-3-methylmorpholin-4-yl]-6-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]-1H-pyridin-2-one
CID 130360002
4-[(3R)-3-methylmorpholin-4-yl]-1H-pyridin-2-one
CID 175744435
6-[2-(3-chlorophenyl)pyrrolidin-1-yl]-4-(3-methylmorpholin-4-yl)-1H-pyridin-2-one
CID 130359968
6-[2-(3-fluorophenyl)pyrrolidin-1-yl]-4-[(3R)-3-methylmorpholin-4-yl]-1H-pyridin-2-one
CID 130344659
6-(2,2-dimethylpyrrolidin-1-yl)-4-[(3R)-3-methylmorpholin-4-yl]-1H-pyridin-2-one
CID 175079373
(3S)-3-methyl-4-[4-[2-[2-(trifluoromethyl)-3-pyridinyl]azetidin-1-yl]pyrido[2,3-d]pyrimidin-2-yl]morpholine
CID 135240110
6-[2-(3-cyclopropylphenyl)pyrrolidin-1-yl]-4-[(3R)-3-methylmorpholin-4-yl]-1H-pyridin-2-one
CID 130344691
CID 175027135
CID 175027135
2-(3-methylmorpholin-4-yl)-N-[[2-(trifluoromethyl)-3-pyridinyl]methyl]pyrido[2,3-d]pyrimidin-4-amine
CID 135240090

Frequently Asked Questions

What is the IUPAC name of 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one?
The IUPAC name of 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one (CID 130344638) is 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one.
What is the SMILES notation for 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one?
The canonical SMILES for 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one is C[C@@H]1COCCN1c1cc(-c2cccnc2C(F)(F)F)[nH]c(=O)c1.
What is the InChIKey of 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one?
The InChIKey is NIYLGOFXXWDGHE-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H16F3N3O2/c1-10-9-24-6-5-22(10)11-7-13(21-14(23)8-11)12-3-2-4-20-15(12)16(17,18)19/h2-4,7-8,10H,5-6,9H2,1H3,(H,21,23)/t10-/m1/s1.
What are the key properties of 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one?
4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one has a molecular weight of 339.32 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3R)-3-methylmorpholin-4-yl]-6-[2-(trifluoromethyl)-3-pyridinyl]-1H-pyridin-2-one is sourced from PubChem (CID 130344638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).