4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine

C15H14F3N3O — CID 796071

IUPAC4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCOCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C15H14F3N3O/c16-15(17,18)12-10-13(21-6-8-22-9-7-21)20-14(19-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2
InChIKeyWZGQODRSOTVKHC-UHFFFAOYSA-N
MW309.29 g/mol
LogP3.00
Rot. Bonds2

About 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine

4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine (PubChem CID 796071) has the molecular formula C15H14F3N3O and a molecular weight of 309.29 g/mol. Its IUPAC name is 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine
PubChem CID796071
Molecular FormulaC15H14F3N3O
Molecular Weight309.29 g/mol
Exact Mass309.11
IUPAC Name4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine
SMILESFC(F)(F)c1cc(N2CCOCC2)nc(-c2ccccc2)n1
InChIInChI=1S/C15H14F3N3O/c16-15(17,18)12-10-13(21-6-8-22-9-7-21)20-14(19-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2
InChIKeyWZGQODRSOTVKHC-UHFFFAOYSA-N
XLogP3.00
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.29
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Morpholin-4-Yl)-6-[4-(Trifluoromethyl)phenyl]pyrimidin-2-Amine
CID 75815439
4-(4-Methylpiperidin-1-Yl)-6-[4-(Trifluoromethyl)phenyl]pyrimidin-2-Amine
CID 75815440
4-(4-Morpholinyl)-2-phenylquinazoline
CID 675225
4-(3-Piperidin-1-Ylpropyl)-6-[3-(Trifluoromethyl)phenyl]pyrimidine-2-Carbonitrile
CID 11516307
Diethyl-(2-morpholin-4-yl-quinazolin-4-yl)-amine
CID 6457762
4-Quinazolinamine, 2-(4-morpholinyl)-
CID 660065
N-(3-fluorophenyl)-6-methyl-2-(morpholin-4-yl)pyrimidin-4-amine
CID 921801
4-(4-Fluorophenyl)-5-(2-morpholinoethyl)-2-pyrimidinamine
CID 3578049
N-(2,4-dimethylphenyl)-6-methyl-2-(4-morpholinyl)-4-pyrimidinamine
CID 697257
2-Methoxy-4-phenyl-6-(trifluoromethyl)pyrimidine
CID 891604
4-(4-Morpholinyl)-2,6-diphenyl-5-pyrimidinecarbonitrile
CID 1480495
4-(2,6-Diphenyl-pyrimidin-4-yl)-morpholine
CID 656281

Frequently Asked Questions

What is the IUPAC name of 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine (CID 796071) is 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine is FC(F)(F)c1cc(N2CCOCC2)nc(-c2ccccc2)n1.
What is the InChIKey of 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
The InChIKey is WZGQODRSOTVKHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N3O/c16-15(17,18)12-10-13(21-6-8-22-9-7-21)20-14(19-12)11-4-2-1-3-5-11/h1-5,10H,6-9H2.
What are the key properties of 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine?
4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine has a molecular weight of 309.29 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-phenyl-6-(trifluoromethyl)pyrimidin-4-yl]morpholine is sourced from PubChem (CID 796071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).