1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol

C18H22N6O — CID 163305995

IUPAC1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
SMILESCN(C)c1ncccc1-c1cnc2c(N3CCC(O)CC3)nccn12
InChIInChI=1S/C18H22N6O/c1-22(2)16-14(4-3-7-19-16)15-12-21-18-17(20-8-11-24(15)18)23-9-5-13(25)6-10-23/h3-4,7-8,11-13,25H,5-6,9-10H2,1-2H3
InChIKeyKOLSSYDBZDBACX-UHFFFAOYSA-N
MW338.42 g/mol
LogP1.82
Rot. Bonds3

About 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol

1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol (PubChem CID 163305995) has the molecular formula C18H22N6O and a molecular weight of 338.42 g/mol. Its IUPAC name is 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
PubChem CID163305995
Molecular FormulaC18H22N6O
Molecular Weight338.42 g/mol
Exact Mass338.19
IUPAC Name1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol
SMILESCN(C)c1ncccc1-c1cnc2c(N3CCC(O)CC3)nccn12
InChIInChI=1S/C18H22N6O/c1-22(2)16-14(4-3-7-19-16)15-12-21-18-17(20-8-11-24(15)18)23-9-5-13(25)6-10-23/h3-4,7-8,11-13,25H,5-6,9-10H2,1-2H3
InChIKeyKOLSSYDBZDBACX-UHFFFAOYSA-N
XLogP1.82
TPSA69.79 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.42
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol?
The IUPAC name of 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol (CID 163305995) is 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol.
What is the SMILES notation for 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol?
The canonical SMILES for 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol is CN(C)c1ncccc1-c1cnc2c(N3CCC(O)CC3)nccn12.
What is the InChIKey of 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol?
The InChIKey is KOLSSYDBZDBACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6O/c1-22(2)16-14(4-3-7-19-16)15-12-21-18-17(20-8-11-24(15)18)23-9-5-13(25)6-10-23/h3-4,7-8,11-13,25H,5-6,9-10H2,1-2H3.
What are the key properties of 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol?
1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol has a molecular weight of 338.42 g/mol, XLogP of 1.82, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[2-(dimethylamino)-3-pyridinyl]imidazo[1,2-a]pyrazin-8-yl]piperidin-4-ol is sourced from PubChem (CID 163305995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).