2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol

C14H16FN3O — CID 86774571

IUPAC2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol
SMILESOC(CN1CCn2ccnc2C1)c1cccc(F)c1
InChIInChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)13(19)9-17-6-7-18-5-4-16-14(18)10-17/h1-5,8,13,19H,6-7,9-10H2
InChIKeyACPMTDQAFHLCCJ-UHFFFAOYSA-N
MW261.30 g/mol
LogP1.57
Rot. Bonds3

About 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol

2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol (PubChem CID 86774571) has the molecular formula C14H16FN3O and a molecular weight of 261.30 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol
PubChem CID86774571
Molecular FormulaC14H16FN3O
Molecular Weight261.30 g/mol
Exact Mass261.13
IUPAC Name2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol
SMILESOC(CN1CCn2ccnc2C1)c1cccc(F)c1
InChIInChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)13(19)9-17-6-7-18-5-4-16-14(18)10-17/h1-5,8,13,19H,6-7,9-10H2
InChIKeyACPMTDQAFHLCCJ-UHFFFAOYSA-N
XLogP1.57
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol?
The IUPAC name of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol (CID 86774571) is 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol.
What is the SMILES notation for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol?
The canonical SMILES for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol is OC(CN1CCn2ccnc2C1)c1cccc(F)c1.
What is the InChIKey of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol?
The InChIKey is ACPMTDQAFHLCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O/c15-12-3-1-2-11(8-12)13(19)9-17-6-7-18-5-4-16-14(18)10-17/h1-5,8,13,19H,6-7,9-10H2.
What are the key properties of 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol?
2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol has a molecular weight of 261.30 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-1-(3-fluorophenyl)ethanol is sourced from PubChem (CID 86774571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).