2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine

C16H18N4O — CID 63898851

IUPAC2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine
SMILESNCC(c1cc2ccccc2o1)N1CCn2ccnc2C1
InChIInChI=1S/C16H18N4O/c17-10-13(15-9-12-3-1-2-4-14(12)21-15)20-8-7-19-6-5-18-16(19)11-20/h1-6,9,13H,7-8,10-11,17H2
InChIKeyXRRGSOTTXZBQKL-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.14
Rot. Bonds3

About 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine

2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine (PubChem CID 63898851) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine.

Molecular Properties

Compound Name2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine
PubChem CID63898851
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine
SMILESNCC(c1cc2ccccc2o1)N1CCn2ccnc2C1
InChIInChI=1S/C16H18N4O/c17-10-13(15-9-12-3-1-2-4-14(12)21-15)20-8-7-19-6-5-18-16(19)11-20/h1-6,9,13H,7-8,10-11,17H2
InChIKeyXRRGSOTTXZBQKL-UHFFFAOYSA-N
XLogP2.14
TPSA60.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine?
The IUPAC name of 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine (CID 63898851) is 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine.
What is the SMILES notation for 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine?
The canonical SMILES for 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine is NCC(c1cc2ccccc2o1)N1CCn2ccnc2C1.
What is the InChIKey of 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine?
The InChIKey is XRRGSOTTXZBQKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c17-10-13(15-9-12-3-1-2-4-14(12)21-15)20-8-7-19-6-5-18-16(19)11-20/h1-6,9,13H,7-8,10-11,17H2.
What are the key properties of 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine?
2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine has a molecular weight of 282.35 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzofuran-2-yl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)ethanamine is sourced from PubChem (CID 63898851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).