(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone

C24H23F3N4O2 — CID 150380192

IUPAC(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
SMILESO=C(c1cn2c(n1)CNC(c1ccccc1)C2)N1CCOC(c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C24H23F3N4O2/c25-24(26,27)18-8-4-7-17(11-18)21-15-30(9-10-33-21)23(32)20-14-31-13-19(28-12-22(31)29-20)16-5-2-1-3-6-16/h1-8,11,14,19,21,28H,9-10,12-13,15H2
InChIKeyGZONNWBNVMSCDR-UHFFFAOYSA-N
MW456.47 g/mol
LogP3.96
Rot. Bonds3

About (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone

(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone (PubChem CID 150380192) has the molecular formula C24H23F3N4O2 and a molecular weight of 456.47 g/mol. Its IUPAC name is (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Name(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
PubChem CID150380192
Molecular FormulaC24H23F3N4O2
Molecular Weight456.47 g/mol
Exact Mass456.18
IUPAC Name(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone
SMILESO=C(c1cn2c(n1)CNC(c1ccccc1)C2)N1CCOC(c2cccc(C(F)(F)F)c2)C1
InChIInChI=1S/C24H23F3N4O2/c25-24(26,27)18-8-4-7-17(11-18)21-15-30(9-10-33-21)23(32)20-14-31-13-19(28-12-22(31)29-20)16-5-2-1-3-6-16/h1-8,11,14,19,21,28H,9-10,12-13,15H2
InChIKeyGZONNWBNVMSCDR-UHFFFAOYSA-N
XLogP3.96
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.47
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The IUPAC name of (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone (CID 150380192) is (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone.
What is the SMILES notation for (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The canonical SMILES for (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone is O=C(c1cn2c(n1)CNC(c1ccccc1)C2)N1CCOC(c2cccc(C(F)(F)F)c2)C1.
What is the InChIKey of (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
The InChIKey is GZONNWBNVMSCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23F3N4O2/c25-24(26,27)18-8-4-7-17(11-18)21-15-30(9-10-33-21)23(32)20-14-31-13-19(28-12-22(31)29-20)16-5-2-1-3-6-16/h1-8,11,14,19,21,28H,9-10,12-13,15H2.
What are the key properties of (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone?
(6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone has a molecular weight of 456.47 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6-phenyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-[2-[3-(trifluoromethyl)phenyl]morpholin-4-yl]methanone is sourced from PubChem (CID 150380192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).