1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone

C13H11N5O — CID 71291104

IUPAC1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone
SMILESCC(=O)c1nc(-c2ccccn2)c2c(N)nccn12
InChIInChI=1S/C13H11N5O/c1-8(19)13-17-10(9-4-2-3-5-15-9)11-12(14)16-6-7-18(11)13/h2-7H,1H3,(H2,14,16)
InChIKeyFEVJFDKVWKDPRL-UHFFFAOYSA-N
MW253.27 g/mol
LogP1.58
Rot. Bonds2

About 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone

1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone (PubChem CID 71291104) has the molecular formula C13H11N5O and a molecular weight of 253.27 g/mol. Its IUPAC name is 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone.

Molecular Properties

Compound Name1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone
PubChem CID71291104
Molecular FormulaC13H11N5O
Molecular Weight253.27 g/mol
Exact Mass253.10
IUPAC Name1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone
SMILESCC(=O)c1nc(-c2ccccn2)c2c(N)nccn12
InChIInChI=1S/C13H11N5O/c1-8(19)13-17-10(9-4-2-3-5-15-9)11-12(14)16-6-7-18(11)13/h2-7H,1H3,(H2,14,16)
InChIKeyFEVJFDKVWKDPRL-UHFFFAOYSA-N
XLogP1.58
TPSA86.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone?
The IUPAC name of 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone (CID 71291104) is 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone.
What is the SMILES notation for 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone?
The canonical SMILES for 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone is CC(=O)c1nc(-c2ccccn2)c2c(N)nccn12.
What is the InChIKey of 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone?
The InChIKey is FEVJFDKVWKDPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5O/c1-8(19)13-17-10(9-4-2-3-5-15-9)11-12(14)16-6-7-18(11)13/h2-7H,1H3,(H2,14,16).
What are the key properties of 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone?
1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone has a molecular weight of 253.27 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-amino-1-pyridin-2-ylimidazo[1,5-a]pyrazin-3-yl)ethanone is sourced from PubChem (CID 71291104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).