4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine

C15H14F2N6O — CID 139358002

IUPAC4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine
SMILESFC(F)c1cn2c(-c3nccc(N4CCOCC4)n3)cnc2cn1
InChIInChI=1S/C15H14F2N6O/c16-14(17)10-9-23-11(7-20-13(23)8-19-10)15-18-2-1-12(21-15)22-3-5-24-6-4-22/h1-2,7-9,14H,3-6H2
InChIKeyNIYQXEWGDLRIRI-UHFFFAOYSA-N
MW332.31 g/mol
LogP1.96
Rot. Bonds3

About 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine

4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine (PubChem CID 139358002) has the molecular formula C15H14F2N6O and a molecular weight of 332.31 g/mol. Its IUPAC name is 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine.

Molecular Properties

Compound Name4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine
PubChem CID139358002
Molecular FormulaC15H14F2N6O
Molecular Weight332.31 g/mol
Exact Mass332.12
IUPAC Name4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine
SMILESFC(F)c1cn2c(-c3nccc(N4CCOCC4)n3)cnc2cn1
InChIInChI=1S/C15H14F2N6O/c16-14(17)10-9-23-11(7-20-13(23)8-19-10)15-18-2-1-12(21-15)22-3-5-24-6-4-22/h1-2,7-9,14H,3-6H2
InChIKeyNIYQXEWGDLRIRI-UHFFFAOYSA-N
XLogP1.96
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.31
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

5-(8-Morpholin-4-ylimidazo[1,2-a]pyrazin-6-yl)pyrimidin-2-amine
CID 90067939
8-(4-Pyrimidin-2-ylpiperazin-1-yl)imidazo[1,2-a]pyrazine
CID 44415514
4-[7-(Trifluoromethyl)imidazo[1,2-a]pyrimidin-3-yl]morpholine
CID 134848884
4-Imidazo[1,2-a]pyrimidin-3-ylmorpholine
CID 3757823
2-Morpholinopteridine
CID 21764873
Pyrimidine, 5-fluoro-4-(4-methylimidazol-1-yl)-2-(4-morpholyl)-
CID 621876
9-(2-methoxypyrimidin-4-yl)-N-methyl-2-(trifluoromethyl)purin-6-amine
CID 10019190
N-cyclopropyl-9-(2-morpholin-4-ylpyrimidin-4-yl)-2-(trifluoromethyl)purin-6-amine
CID 10409040
3-[[4-(Pyrimidin-2-ylmethyl)morpholin-2-yl]methyl]-5-(trifluoromethyl)triazolo[4,5-d]pyrimidin-7-amine
CID 52938508
3-[(4-Pyrimidin-2-ylmorpholin-2-yl)methyl]-5-(trifluoromethyl)triazolo[4,5-d]pyrimidin-7-amine
CID 52938636
2-(2-aminopyrimidin-5-yl)-8-chloro-6-(morpholin-4-yl)-9-(2,2,2-trifluoroethyl)-9H-purine
CID 59333534
5-[6-Morpholin-4-yl-9-(2,2,2-trifluoroethyl)purin-2-yl]pyrimidin-2-amine
CID 59333581

Frequently Asked Questions

What is the IUPAC name of 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine?
The IUPAC name of 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine (CID 139358002) is 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine.
What is the SMILES notation for 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine?
The canonical SMILES for 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine is FC(F)c1cn2c(-c3nccc(N4CCOCC4)n3)cnc2cn1.
What is the InChIKey of 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine?
The InChIKey is NIYQXEWGDLRIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N6O/c16-14(17)10-9-23-11(7-20-13(23)8-19-10)15-18-2-1-12(21-15)22-3-5-24-6-4-22/h1-2,7-9,14H,3-6H2.
What are the key properties of 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine?
4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine has a molecular weight of 332.31 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]morpholine is sourced from PubChem (CID 139358002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).