2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol

C18H22N6O — CID 126475538

IUPAC2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
SMILESNc1ccc(-c2cnc(N3CCN(CCO)CC3)c3nccn23)cc1
InChIInChI=1S/C18H22N6O/c19-15-3-1-14(2-4-15)16-13-21-17(18-20-5-6-24(16)18)23-9-7-22(8-10-23)11-12-25/h1-6,13,25H,7-12,19H2
InChIKeyTVNRMUVKEZCEAT-UHFFFAOYSA-N
MW338.42 g/mol
LogP1.09
Rot. Bonds4

About 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol

2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol (PubChem CID 126475538) has the molecular formula C18H22N6O and a molecular weight of 338.42 g/mol. Its IUPAC name is 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
PubChem CID126475538
Molecular FormulaC18H22N6O
Molecular Weight338.42 g/mol
Exact Mass338.19
IUPAC Name2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
SMILESNc1ccc(-c2cnc(N3CCN(CCO)CC3)c3nccn23)cc1
InChIInChI=1S/C18H22N6O/c19-15-3-1-14(2-4-15)16-13-21-17(18-20-5-6-24(16)18)23-9-7-22(8-10-23)11-12-25/h1-6,13,25H,7-12,19H2
InChIKeyTVNRMUVKEZCEAT-UHFFFAOYSA-N
XLogP1.09
TPSA82.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.42
LogP ≤ 51.09
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

2-[4-(5-phenylimidazo[1,2-a]pyrazin-8-yl)piperazin-1-yl]ethanol
CID 126473750
2-[4-[3-(4-methylphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
CID 126472836
2-[4-[3-(3-chlorophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
CID 46241787
2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
CID 126474260
[4-[3-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 126473544
[2-[8-[4-[2-(diethylamino)ethyl]piperazin-1-yl]imidazo[1,2-a]pyrazin-5-yl]phenyl]methanol
CID 126474976
2-[4-(6-pyridin-4-yl-3-pyrrolidin-1-ylpyrazin-2-yl)piperazin-1-yl]ethanol;trihydrochloride
CID 67379907
1-[2-[4-[5-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]-2-oxoethyl]pyridin-2-one
CID 155870446
[3-(8-pyrrolidin-1-ylimidazo[1,2-a]pyrazin-3-yl)phenyl]methanol
CID 163318005
8-[4-[(3,5-dimethylphenyl)methyl]piperazin-1-yl]-3-pyridin-4-ylimidazo[1,2-a]pyrazine;tris(2,2,2-trifluoroacetic acid)
CID 155848563
2-[4-(5-amino-6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]ethanol
CID 19137446
8-piperazin-1-yl-5-thiophen-3-ylimidazo[1,2-a]pyrazine
CID 58446975

Frequently Asked Questions

What is the IUPAC name of 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol (CID 126475538) is 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol is Nc1ccc(-c2cnc(N3CCN(CCO)CC3)c3nccn23)cc1.
What is the InChIKey of 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The InChIKey is TVNRMUVKEZCEAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O/c19-15-3-1-14(2-4-15)16-13-21-17(18-20-5-6-24(16)18)23-9-7-22(8-10-23)11-12-25/h1-6,13,25H,7-12,19H2.
What are the key properties of 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol has a molecular weight of 338.42 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[5-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol is sourced from PubChem (CID 126475538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).