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

C23H24N6O2 — CID 137120128

IUPAC4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1ccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)cc1
InChIInChI=1S/C23H24N6O2/c30-19-4-1-17(2-5-19)21-14-27-23-15-25-20(16-29(21)23)18-3-6-22(26-13-18)24-7-8-28-9-11-31-12-10-28/h1-6,13-16,30H,7-12H2,(H,24,26)
InChIKeyKDMZGEUMCUKXOL-UHFFFAOYSA-N
MW416.49 g/mol
LogP2.91
Rot. Bonds6

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

4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol (PubChem CID 137120128) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol.

Molecular Properties

Compound Name4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
PubChem CID137120128
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol
SMILESOc1ccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)cc1
InChIInChI=1S/C23H24N6O2/c30-19-4-1-17(2-5-19)21-14-27-23-15-25-20(16-29(21)23)18-3-6-22(26-13-18)24-7-8-28-9-11-31-12-10-28/h1-6,13-16,30H,7-12H2,(H,24,26)
InChIKeyKDMZGEUMCUKXOL-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 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The IUPAC name of 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol (CID 137120128) is 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol.
What is the SMILES notation for 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The canonical SMILES for 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol is Oc1ccc(-c2cnc3cnc(-c4ccc(NCCN5CCOCC5)nc4)cn23)cc1.
What is the InChIKey of 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
The InChIKey is KDMZGEUMCUKXOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c30-19-4-1-17(2-5-19)21-14-27-23-15-25-20(16-29(21)23)18-3-6-22(26-13-18)24-7-8-28-9-11-31-12-10-28/h1-6,13-16,30H,7-12H2,(H,24,26).
What are the key properties of 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol?
4-[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 4-[6-[6-(2-morpholin-4-ylethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-3-yl]phenol is sourced from PubChem (CID 137120128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).