[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol

C22H24N8O2 — CID 118161077

IUPAC[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol
SMILESCc1ncc(-c2cn3ccnc3c(Nc3ccc(N4CCOC(CO)C4)cc3)n2)nc1N
InChIInChI=1S/C22H24N8O2/c1-14-20(23)27-18(10-25-14)19-12-30-7-6-24-22(30)21(28-19)26-15-2-4-16(5-3-15)29-8-9-32-17(11-29)13-31/h2-7,10,12,17,31H,8-9,11,13H2,1H3,(H2,23,27)(H,26,28)
InChIKeyZNTHWWPFKRIXOD-UHFFFAOYSA-N
MW432.49 g/mol
LogP2.02
Rot. Bonds5

About [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol

[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol (PubChem CID 118161077) has the molecular formula C22H24N8O2 and a molecular weight of 432.49 g/mol. Its IUPAC name is [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol
PubChem CID118161077
Molecular FormulaC22H24N8O2
Molecular Weight432.49 g/mol
Exact Mass432.20
IUPAC Name[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol
SMILESCc1ncc(-c2cn3ccnc3c(Nc3ccc(N4CCOC(CO)C4)cc3)n2)nc1N
InChIInChI=1S/C22H24N8O2/c1-14-20(23)27-18(10-25-14)19-12-30-7-6-24-22(30)21(28-19)26-15-2-4-16(5-3-15)29-8-9-32-17(11-29)13-31/h2-7,10,12,17,31H,8-9,11,13H2,1H3,(H2,23,27)(H,26,28)
InChIKeyZNTHWWPFKRIXOD-UHFFFAOYSA-N
XLogP2.02
TPSA126.72 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol (CID 118161077) is [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol is Cc1ncc(-c2cn3ccnc3c(Nc3ccc(N4CCOC(CO)C4)cc3)n2)nc1N.
What is the InChIKey of [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol?
The InChIKey is ZNTHWWPFKRIXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N8O2/c1-14-20(23)27-18(10-25-14)19-12-30-7-6-24-22(30)21(28-19)26-15-2-4-16(5-3-15)29-8-9-32-17(11-29)13-31/h2-7,10,12,17,31H,8-9,11,13H2,1H3,(H2,23,27)(H,26,28).
What are the key properties of [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol?
[4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol has a molecular weight of 432.49 g/mol, XLogP of 2.02, 5 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-[[6-(6-amino-5-methylpyrazin-2-yl)imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]morpholin-2-yl]methanol is sourced from PubChem (CID 118161077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).