1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol

C16H17N5O — CID 163317288

IUPAC1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
SMILESNc1cccc(-c2cnc3c(N4CCC(O)C4)nccn23)c1
InChIInChI=1S/C16H17N5O/c17-12-3-1-2-11(8-12)14-9-19-16-15(18-5-7-21(14)16)20-6-4-13(22)10-20/h1-3,5,7-9,13,22H,4,6,10,17H2
InChIKeyHXXVPTGFUUTHMZ-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.55
Rot. Bonds2

About 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol

1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol (PubChem CID 163317288) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol.

Molecular Properties

Compound Name1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
PubChem CID163317288
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
SMILESNc1cccc(-c2cnc3c(N4CCC(O)C4)nccn23)c1
InChIInChI=1S/C16H17N5O/c17-12-3-1-2-11(8-12)14-9-19-16-15(18-5-7-21(14)16)20-6-4-13(22)10-20/h1-3,5,7-9,13,22H,4,6,10,17H2
InChIKeyHXXVPTGFUUTHMZ-UHFFFAOYSA-N
XLogP1.55
TPSA79.68 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

acetic acid;1-[3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol
CID 166599371
[3-(8-pyrrolidin-1-ylimidazo[1,2-a]pyrazin-3-yl)phenyl]methanol
CID 163318005
1-[3-[4-fluoro-3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163310971
1-(3-pyrazolo[1,5-a]pyridin-7-ylimidazo[1,2-a]pyrazin-8-yl)piperidin-4-ol
CID 163317910
2-[4-[3-(3-chlorophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
CID 46241787
1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163305995
(3R)-1-(4-amino-2-pyridinyl)pyrrolidin-3-ol
CID 94895351
1-[3-(2-methoxyquinolin-3-yl)imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
CID 163313692
2-[(3S)-3-hydroxypyrrolidin-1-yl]pyridin-3-ol
CID 71649435
1-(5-amino-3-methyl-2-pyridinyl)pyrrolidin-3-ol
CID 62918540
[4-[3-(4-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 126473544
(3S)-1-(5-amino-3-fluoro-2-pyridinyl)pyrrolidin-3-ol;hydrochloride
CID 140703881

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The IUPAC name of 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol (CID 163317288) is 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol.
What is the SMILES notation for 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The canonical SMILES for 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol is Nc1cccc(-c2cnc3c(N4CCC(O)C4)nccn23)c1.
What is the InChIKey of 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
The InChIKey is HXXVPTGFUUTHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c17-12-3-1-2-11(8-12)14-9-19-16-15(18-5-7-21(14)16)20-6-4-13(22)10-20/h1-3,5,7-9,13,22H,4,6,10,17H2.
What are the key properties of 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol?
1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol has a molecular weight of 295.35 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3-aminophenyl)imidazo[1,2-a]pyrazin-8-yl]pyrrolidin-3-ol is sourced from PubChem (CID 163317288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).