3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one

C10H13N5O — CID 22293278

IUPAC3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one
SMILESO=c1[nH]c2nccnc2n1C1CCNCC1
InChIInChI=1S/C10H13N5O/c16-10-14-8-9(13-6-5-12-8)15(10)7-1-3-11-4-2-7/h5-7,11H,1-4H2,(H,12,14,16)
InChIKeyAEUJTZJJOJMFJG-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.04
Rot. Bonds1

About 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one

3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one (PubChem CID 22293278) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one.

Molecular Properties

Compound Name3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one
PubChem CID22293278
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one
SMILESO=c1[nH]c2nccnc2n1C1CCNCC1
InChIInChI=1S/C10H13N5O/c16-10-14-8-9(13-6-5-12-8)15(10)7-1-3-11-4-2-7/h5-7,11H,1-4H2,(H,12,14,16)
InChIKeyAEUJTZJJOJMFJG-UHFFFAOYSA-N
XLogP0.04
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The IUPAC name of 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one (CID 22293278) is 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one.
What is the SMILES notation for 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The canonical SMILES for 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one is O=c1[nH]c2nccnc2n1C1CCNCC1.
What is the InChIKey of 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one?
The InChIKey is AEUJTZJJOJMFJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c16-10-14-8-9(13-6-5-12-8)15(10)7-1-3-11-4-2-7/h5-7,11H,1-4H2,(H,12,14,16).
What are the key properties of 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one?
3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one has a molecular weight of 219.25 g/mol, XLogP of 0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-1H-imidazo[4,5-b]pyrazin-2-one is sourced from PubChem (CID 22293278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).