1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone

C15H21N5O — CID 166104347

IUPAC1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone
SMILESCCc1cnc2c(n1)nc(C1CCN(C(C)=O)CC1)n2C
InChIInChI=1S/C15H21N5O/c1-4-12-9-16-15-13(17-12)18-14(19(15)3)11-5-7-20(8-6-11)10(2)21/h9,11H,4-8H2,1-3H3
InChIKeyJCHLREKHOWNCEH-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.65
Rot. Bonds2

About 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone

1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone (PubChem CID 166104347) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone
PubChem CID166104347
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone
SMILESCCc1cnc2c(n1)nc(C1CCN(C(C)=O)CC1)n2C
InChIInChI=1S/C15H21N5O/c1-4-12-9-16-15-13(17-12)18-14(19(15)3)11-5-7-20(8-6-11)10(2)21/h9,11H,4-8H2,1-3H3
InChIKeyJCHLREKHOWNCEH-UHFFFAOYSA-N
XLogP1.65
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone (CID 166104347) is 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone is CCc1cnc2c(n1)nc(C1CCN(C(C)=O)CC1)n2C.
What is the InChIKey of 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone?
The InChIKey is JCHLREKHOWNCEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-12-9-16-15-13(17-12)18-14(19(15)3)11-5-7-20(8-6-11)10(2)21/h9,11H,4-8H2,1-3H3.
What are the key properties of 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone?
1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone has a molecular weight of 287.37 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(5-ethyl-1-methylimidazo[4,5-b]pyrazin-2-yl)piperidin-1-yl]ethanone is sourced from PubChem (CID 166104347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).