2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone

C22H26N4O3 — CID 165031668

IUPAC2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone
SMILESCOc1nc(CC(=O)c2cccc(C(C)C)n2)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C22H26N4O3/c1-14(2)17-5-4-6-18(24-17)20(27)11-16-12-26-13-19(15-7-9-29-10-8-15)25-21(26)22(23-16)28-3/h4-6,12-15H,7-11H2,1-3H3
InChIKeyMTDSZOQYAAYBSX-UHFFFAOYSA-N
MW394.48 g/mol
LogP3.58
Rot. Bonds6

About 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone

2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone (PubChem CID 165031668) has the molecular formula C22H26N4O3 and a molecular weight of 394.48 g/mol. Its IUPAC name is 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone
PubChem CID165031668
Molecular FormulaC22H26N4O3
Molecular Weight394.48 g/mol
Exact Mass394.20
IUPAC Name2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone
SMILESCOc1nc(CC(=O)c2cccc(C(C)C)n2)cn2cc(C3CCOCC3)nc12
InChIInChI=1S/C22H26N4O3/c1-14(2)17-5-4-6-18(24-17)20(27)11-16-12-26-13-19(15-7-9-29-10-8-15)25-21(26)22(23-16)28-3/h4-6,12-15H,7-11H2,1-3H3
InChIKeyMTDSZOQYAAYBSX-UHFFFAOYSA-N
XLogP3.58
TPSA78.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.48
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-6-propan-2-ylpyridine-2-carboxamide
CID 154655177
2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(1-methylpyrazol-3-yl)ethanone
CID 165048614
2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-[1-(2-methylpropyl)pyrazol-3-yl]ethanone
CID 165050739
6-bromo-8-methoxy-2-(oxan-3-yl)imidazo[1,2-a]pyrazine;1-[6-(difluoromethyl)-2-pyridinyl]-2-[8-methoxy-2-(oxan-3-yl)imidazo[1,2-a]pyrazin-6-yl]ethanone
CID 164984762
N-(2-cyclopropyl-8-methoxyimidazo[1,2-a]pyrazin-6-yl)-6-(difluoromethyl)pyridine-2-carboxamide
CID 154655470
1-[6-(difluoromethyl)-2-pyridinyl]-2-[7-fluoro-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]ethanone
CID 165046881
1-[6-(difluoromethyl)-2-pyridinyl]-2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]ethanone
CID 164961282
2-methoxy-N-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]pyridine-3-carboxamide
CID 154655303
2-[7-ethoxy-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]-1-[6-(methoxymethyl)-2-pyridinyl]ethanone
CID 164986455
6-(difluoromethyl)-N-[8-methoxy-2-(3-oxabicyclo[4.1.0]heptan-7-yl)imidazo[1,2-a]pyrazin-6-yl]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998256
2-[2-cyclopropyl-7-(2-methoxyethoxy)imidazo[1,2-a]pyridin-6-yl]-1-[6-(difluoromethyl)-2-pyridinyl]ethanone
CID 164979534
6-(difluoromethyl)-N-[8-methyl-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;2,2,2-trifluoroacetic acid
CID 154998213

Frequently Asked Questions

What is the IUPAC name of 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone?
The IUPAC name of 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone (CID 165031668) is 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone?
The canonical SMILES for 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone is COc1nc(CC(=O)c2cccc(C(C)C)n2)cn2cc(C3CCOCC3)nc12.
What is the InChIKey of 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone?
The InChIKey is MTDSZOQYAAYBSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O3/c1-14(2)17-5-4-6-18(24-17)20(27)11-16-12-26-13-19(15-7-9-29-10-8-15)25-21(26)22(23-16)28-3/h4-6,12-15H,7-11H2,1-3H3.
What are the key properties of 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone?
2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone has a molecular weight of 394.48 g/mol, XLogP of 3.58, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-methoxy-2-(oxan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(6-propan-2-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 165031668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).