6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine

C24H26N6O — CID 58688031

IUPAC6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1c(N)cccc1-c1cn2ccnc2c(Nc2ccc(CN3CCOCC3)cc2)n1
InChIInChI=1S/C24H26N6O/c1-17-20(3-2-4-21(17)25)22-16-30-10-9-26-24(30)23(28-22)27-19-7-5-18(6-8-19)15-29-11-13-31-14-12-29/h2-10,16H,11-15,25H2,1H3,(H,27,28)
InChIKeyHXURBNSUBXIYOW-UHFFFAOYSA-N
MW414.51 g/mol
LogP3.86
Rot. Bonds5

About 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine

6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 58688031) has the molecular formula C24H26N6O and a molecular weight of 414.51 g/mol. Its IUPAC name is 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound Name6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID58688031
Molecular FormulaC24H26N6O
Molecular Weight414.51 g/mol
Exact Mass414.22
IUPAC Name6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCc1c(N)cccc1-c1cn2ccnc2c(Nc2ccc(CN3CCOCC3)cc2)n1
InChIInChI=1S/C24H26N6O/c1-17-20(3-2-4-21(17)25)22-16-30-10-9-26-24(30)23(28-22)27-19-7-5-18(6-8-19)15-29-11-13-31-14-12-29/h2-10,16H,11-15,25H2,1H3,(H,27,28)
InChIKeyHXURBNSUBXIYOW-UHFFFAOYSA-N
XLogP3.86
TPSA80.71 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-(3-amino-2-methylphenyl)-1-methyl-3-[4-(morpholin-4-ylmethyl)anilino]pyrazin-2-one
CID 68874747
N-[2-methyl-3-[8-[4-(morpholin-4-ylmethyl)anilino]imidazo[1,2-a]pyrazin-6-yl]phenyl]pyridine-3-carboxamide
CID 68933186
4-tert-butyl-N-[2-methyl-3-[8-[4-(morpholine-4-carbonyl)anilino]imidazo[1,2-a]pyrazin-6-yl]phenyl]benzamide
CID 11714059
[4-[[6-[1-(6-methylpyridine-3-carbonyl)-2,3-dihydroindol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone
CID 78320959
6-(3-hydrazinylphenyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 144744402
6-[3-(methylsulfonylmethyl)phenyl]-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 152942999
5-(3-amino-2-methylphenyl)-1-methyl-3-[4-(morpholine-4-carbonyl)anilino]pyrazin-2-one
CID 46942383
[4-[[6-[1-(4-tert-butylbenzoyl)indol-4-yl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-morpholin-4-ylmethanone
CID 78320014
8-N-(4-ethylphenyl)imidazo[1,2-a]pyrazine-6,8-diamine
CID 80761933
6-(5-ethyl-3-pyridinyl)-N-(4-morpholin-4-ylphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 147813694
(4Z)-4-[(Z)-but-2-enylidene]-5-methylidene-N-[2-methyl-3-[8-[4-(morpholine-4-carbonyl)anilino]imidazo[1,2-a]pyrazin-6-yl]phenyl]-1H-pyrrole-3-carboxamide
CID 143229964
4-tert-butyl-N-[3-[8-[4-[(4-methylpiperazin-1-yl)methyl]anilino]imidazo[1,2-a]pyrazin-6-yl]phenyl]benzamide
CID 11534309

Frequently Asked Questions

What is the IUPAC name of 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine (CID 58688031) is 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine is Cc1c(N)cccc1-c1cn2ccnc2c(Nc2ccc(CN3CCOCC3)cc2)n1.
What is the InChIKey of 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is HXURBNSUBXIYOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O/c1-17-20(3-2-4-21(17)25)22-16-30-10-9-26-24(30)23(28-22)27-19-7-5-18(6-8-19)15-29-11-13-31-14-12-29/h2-10,16H,11-15,25H2,1H3,(H,27,28).
What are the key properties of 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine?
6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 414.51 g/mol, XLogP of 3.86, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-amino-2-methylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 58688031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).