3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol

C23H24N6O2 — CID 126673164

IUPAC3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1cccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)c1
InChIInChI=1S/C23H24N6O2/c30-19-3-1-2-17(12-19)21-14-27-23-15-25-20(16-29(21)23)18-4-5-22(26-13-18)24-6-7-28-8-10-31-11-9-28/h1-5,12-16,30H,6-11H2,(H,24,26)
InChIKeyHUARNRZBKUZALL-UHFFFAOYSA-N
MW416.49 g/mol
LogP2.91
Rot. Bonds6

About 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol

3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 126673164) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID126673164
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1cccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)c1
InChIInChI=1S/C23H24N6O2/c30-19-3-1-2-17(12-19)21-14-27-23-15-25-20(16-29(21)23)18-4-5-22(26-13-18)24-6-7-28-8-10-31-11-9-28/h1-5,12-16,30H,6-11H2,(H,24,26)
InChIKeyHUARNRZBKUZALL-UHFFFAOYSA-N
XLogP2.91
TPSA87.81 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol (CID 126673164) is 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol is Oc1cccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)c1.
What is the InChIKey of 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is HUARNRZBKUZALL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c30-19-3-1-2-17(12-19)21-14-27-23-15-25-20(16-29(21)23)18-4-5-22(26-13-18)24-6-7-28-8-10-31-11-9-28/h1-5,12-16,30H,6-11H2,(H,24,26).
What are the key properties of 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol has a molecular weight of 416.49 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 126673164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).