1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide

C13H18N6O — CID 80754104

IUPAC1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide
SMILESCNc1cn2ccnc2c(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C13H18N6O/c1-15-10-8-19-7-4-16-12(19)13(17-10)18-5-2-9(3-6-18)11(14)20/h4,7-9,15H,2-3,5-6H2,1H3,(H2,14,20)
InChIKeyQXEMORLYOXBMPV-UHFFFAOYSA-N
MW274.33 g/mol
LogP0.47
Rot. Bonds3

About 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide

1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide (PubChem CID 80754104) has the molecular formula C13H18N6O and a molecular weight of 274.33 g/mol. Its IUPAC name is 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide
PubChem CID80754104
Molecular FormulaC13H18N6O
Molecular Weight274.33 g/mol
Exact Mass274.15
IUPAC Name1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide
SMILESCNc1cn2ccnc2c(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C13H18N6O/c1-15-10-8-19-7-4-16-12(19)13(17-10)18-5-2-9(3-6-18)11(14)20/h4,7-9,15H,2-3,5-6H2,1H3,(H2,14,20)
InChIKeyQXEMORLYOXBMPV-UHFFFAOYSA-N
XLogP0.47
TPSA88.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide (CID 80754104) is 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide is CNc1cn2ccnc2c(N2CCC(C(N)=O)CC2)n1.
What is the InChIKey of 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide?
The InChIKey is QXEMORLYOXBMPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6O/c1-15-10-8-19-7-4-16-12(19)13(17-10)18-5-2-9(3-6-18)11(14)20/h4,7-9,15H,2-3,5-6H2,1H3,(H2,14,20).
What are the key properties of 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide?
1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide has a molecular weight of 274.33 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperidine-4-carboxamide is sourced from PubChem (CID 80754104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).