4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol

C22H19FN4O2 — CID 137053641

IUPAC4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1ccc(-c2c(-c3cccc(F)c3)nc3c(N4CCOCC4)nccn23)cc1
InChIInChI=1S/C22H19FN4O2/c23-17-3-1-2-16(14-17)19-20(15-4-6-18(28)7-5-15)27-9-8-24-21(22(27)25-19)26-10-12-29-13-11-26/h1-9,14,28H,10-13H2
InChIKeyCTWSNGNABKPFRO-UHFFFAOYSA-N
MW390.42 g/mol
LogP3.74
Rot. Bonds3

About 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol

4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 137053641) has the molecular formula C22H19FN4O2 and a molecular weight of 390.42 g/mol. Its IUPAC name is 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID137053641
Molecular FormulaC22H19FN4O2
Molecular Weight390.42 g/mol
Exact Mass390.15
IUPAC Name4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1ccc(-c2c(-c3cccc(F)c3)nc3c(N4CCOCC4)nccn23)cc1
InChIInChI=1S/C22H19FN4O2/c23-17-3-1-2-16(14-17)19-20(15-4-6-18(28)7-5-15)27-9-8-24-21(22(27)25-19)26-10-12-29-13-11-26/h1-9,14,28H,10-13H2
InChIKeyCTWSNGNABKPFRO-UHFFFAOYSA-N
XLogP3.74
TPSA62.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.42
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol (CID 137053641) is 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol is Oc1ccc(-c2c(-c3cccc(F)c3)nc3c(N4CCOCC4)nccn23)cc1.
What is the InChIKey of 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is CTWSNGNABKPFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O2/c23-17-3-1-2-16(14-17)19-20(15-4-6-18(28)7-5-15)27-9-8-24-21(22(27)25-19)26-10-12-29-13-11-26/h1-9,14,28H,10-13H2.
What are the key properties of 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol?
4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 390.42 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(3-fluorophenyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 137053641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).