methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

C25H30N10O2 — CID 144627266

IUPACmethoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESCCOC.Cc1nnc2c(N)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3cccnc3)cn12
InChIInChI=1S/C22H22N10O.C3H8O/c1-14-28-29-22-20(23)26-17(13-31(14)22)21-27-16-11-25-19(30-5-7-33-8-6-30)9-18(16)32(21)12-15-3-2-4-24-10-15;1-3-4-2/h2-4,9-11,13H,5-8,12H2,1H3,(H2,23,26);3H2,1-2H3
InChIKeyAVBJXNQSJBQIGI-UHFFFAOYSA-N
MW502.58 g/mol
LogP2.36
Rot. Bonds5

About methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine

methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (PubChem CID 144627266) has the molecular formula C25H30N10O2 and a molecular weight of 502.58 g/mol. Its IUPAC name is methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.

Molecular Properties

Compound Namemethoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
PubChem CID144627266
Molecular FormulaC25H30N10O2
Molecular Weight502.58 g/mol
Exact Mass502.26
IUPAC Namemethoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
SMILESCCOC.Cc1nnc2c(N)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3cccnc3)cn12
InChIInChI=1S/C22H22N10O.C3H8O/c1-14-28-29-22-20(23)26-17(13-31(14)22)21-27-16-11-25-19(30-5-7-33-8-6-30)9-18(16)32(21)12-15-3-2-4-24-10-15;1-3-4-2/h2-4,9-11,13H,5-8,12H2,1H3,(H2,23,26);3H2,1-2H3
InChIKeyAVBJXNQSJBQIGI-UHFFFAOYSA-N
XLogP2.36
TPSA134.40 Ų
H-Bond Donors1
H-Bond Acceptors12
Rotatable Bonds5
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.58
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1012

Analyze methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The IUPAC name of methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine (CID 144627266) is methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine.
What is the SMILES notation for methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The canonical SMILES for methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is CCOC.Cc1nnc2c(N)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3cccnc3)cn12.
What is the InChIKey of methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
The InChIKey is AVBJXNQSJBQIGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N10O.C3H8O/c1-14-28-29-22-20(23)26-17(13-31(14)22)21-27-16-11-25-19(30-5-7-33-8-6-30)9-18(16)32(21)12-15-3-2-4-24-10-15;1-3-4-2/h2-4,9-11,13H,5-8,12H2,1H3,(H2,23,26);3H2,1-2H3.
What are the key properties of methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine?
methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine has a molecular weight of 502.58 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethane;3-methyl-6-[6-morpholin-4-yl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]pyridin-2-yl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine is sourced from PubChem (CID 144627266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).