8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide

C22H25N5O4 — CID 155437199

IUPAC8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
SMILESCCOc1nc(C(=O)Nc2cccnc2OC)cn2cc([C@@]34CC[C@@](C)(C3)OC4)nc12
InChIInChI=1S/C22H25N5O4/c1-4-30-20-17-26-16(22-8-7-21(2,12-22)31-13-22)11-27(17)10-15(25-20)18(28)24-14-6-5-9-23-19(14)29-3/h5-6,9-11H,4,7-8,12-13H2,1-3H3,(H,24,28)/t21-,22-/m0/s1
InChIKeyIGBJPEOWFQFQBV-VXKWHMMOSA-N
MW423.47 g/mol
LogP2.99
Rot. Bonds6

About 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide

8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide (PubChem CID 155437199) has the molecular formula C22H25N5O4 and a molecular weight of 423.47 g/mol. Its IUPAC name is 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide.

Molecular Properties

Compound Name8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
PubChem CID155437199
Molecular FormulaC22H25N5O4
Molecular Weight423.47 g/mol
Exact Mass423.19
IUPAC Name8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
SMILESCCOc1nc(C(=O)Nc2cccnc2OC)cn2cc([C@@]34CC[C@@](C)(C3)OC4)nc12
InChIInChI=1S/C22H25N5O4/c1-4-30-20-17-26-16(22-8-7-21(2,12-22)31-13-22)11-27(17)10-15(25-20)18(28)24-14-6-5-9-23-19(14)29-3/h5-6,9-11H,4,7-8,12-13H2,1-3H3,(H,24,28)/t21-,22-/m0/s1
InChIKeyIGBJPEOWFQFQBV-VXKWHMMOSA-N
XLogP2.99
TPSA99.87 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.47
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide with MolForge

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Related Compounds

8-methoxy-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxamide
CID 155437215
8-methoxy-N-(2-methoxy-3-pyridinyl)-2-[(1R,4S)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
CID 155437266
8-ethoxy-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazine-6-carboxylic acid
CID 155437419
N-[6-(difluoromethyl)-2-pyridinyl]-8-ethoxy-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide
CID 155437004
2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)-8-propoxyimidazo[1,2-a]pyrazine-6-carboxylic acid
CID 167420014
phenyl 8-ethoxy-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyrazine-6-carboxylate
CID 155437092
N-[8-methoxy-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-2-methyl-1,3-oxazole-4-carboxamide
CID 154655808
2-[8-fluoro-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)-7-propan-2-yloxyimidazo[1,2-a]pyridin-6-yl]-1-(2-methoxy-3-pyridinyl)ethanone
CID 165109738
2-[8-methoxy-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-1-(2-methoxy-3-pyridinyl)ethanone
CID 165097888
N-[7-cyclopropyloxy-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyrimidin-6-yl]-2-methoxypyridine-3-carboxamide
CID 154655502
N-[8-methoxy-2-(1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl)imidazo[1,2-a]pyrazin-6-yl]-2,3-dihydro-1-benzofuran-7-carboxamide
CID 154655437
7-(difluoromethoxy)-N-(2-methoxy-3-pyridinyl)-2-(1-methyl-2-oxabicyclo[2.1.1]hexan-4-yl)imidazo[1,2-a]pyridine-6-carboxamide
CID 167420134

Frequently Asked Questions

What is the IUPAC name of 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide?
The IUPAC name of 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide (CID 155437199) is 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide.
What is the SMILES notation for 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide?
The canonical SMILES for 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide is CCOc1nc(C(=O)Nc2cccnc2OC)cn2cc([C@@]34CC[C@@](C)(C3)OC4)nc12.
What is the InChIKey of 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide?
The InChIKey is IGBJPEOWFQFQBV-VXKWHMMOSA-N. The full InChI is InChI=1S/C22H25N5O4/c1-4-30-20-17-26-16(22-8-7-21(2,12-22)31-13-22)11-27(17)10-15(25-20)18(28)24-14-6-5-9-23-19(14)29-3/h5-6,9-11H,4,7-8,12-13H2,1-3H3,(H,24,28)/t21-,22-/m0/s1.
What are the key properties of 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide?
8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide has a molecular weight of 423.47 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethoxy-N-(2-methoxy-3-pyridinyl)-2-[(1S,4R)-1-methyl-2-oxabicyclo[2.2.1]heptan-4-yl]imidazo[1,2-a]pyrazine-6-carboxamide is sourced from PubChem (CID 155437199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).