4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine

C22H22N8O — CID 175276114

IUPAC4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine
SMILESCc1ccc2nc(Cn3cc(-c4cc(N5CCOCC5)cc5[nH]ncc45)nn3)cn2c1
InChIInChI=1S/C22H22N8O/c1-15-2-3-22-24-16(12-29(22)11-15)13-30-14-21(26-27-30)18-8-17(28-4-6-31-7-5-28)9-20-19(18)10-23-25-20/h2-3,8-12,14H,4-7,13H2,1H3,(H,23,25)
InChIKeyFGJDOICYJPJNNO-UHFFFAOYSA-N
MW414.47 g/mol
LogP2.66
Rot. Bonds4

About 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine

4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine (PubChem CID 175276114) has the molecular formula C22H22N8O and a molecular weight of 414.47 g/mol. Its IUPAC name is 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine.

Molecular Properties

Compound Name4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine
PubChem CID175276114
Molecular FormulaC22H22N8O
Molecular Weight414.47 g/mol
Exact Mass414.19
IUPAC Name4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine
SMILESCc1ccc2nc(Cn3cc(-c4cc(N5CCOCC5)cc5[nH]ncc45)nn3)cn2c1
InChIInChI=1S/C22H22N8O/c1-15-2-3-22-24-16(12-29(22)11-15)13-30-14-21(26-27-30)18-8-17(28-4-6-31-7-5-28)9-20-19(18)10-23-25-20/h2-3,8-12,14H,4-7,13H2,1H3,(H,23,25)
InChIKeyFGJDOICYJPJNNO-UHFFFAOYSA-N
XLogP2.66
TPSA89.16 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.47
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-[[4-(5-methoxy-1H-indazol-4-yl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
CID 175276141
[4-[1-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]-1H-indazol-6-yl]-morpholin-4-ylmethanone
CID 155167716
1-cyclobutyl-N-[[2-[[4-(6-fluoro-1H-indazol-4-yl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methyl]methanamine;[2-[[4-(6-fluoro-1H-indazol-4-yl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methanol
CID 155167611
4-[1-[[6-[(cyclobutylmethylamino)methyl]imidazo[1,2-a]pyridin-2-yl]methyl]triazol-4-yl]-N-(2-hydroxyethyl)-1H-indazole-6-carboxamide
CID 155167545
1-[[[2-[[4-(1H-indazol-4-yl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methylamino]methyl]cyclohexan-1-ol
CID 155167449
6-(aziridin-1-yl)-4-[1-[[2-(3-cyclobutylpropyl)-1H-indol-6-yl]methyl]triazol-4-yl]-1H-indazole
CID 177373546
2-[[4-(2-chloroethyl)triazol-1-yl]methyl]-6-methylimidazo[1,2-a]pyridine
CID 55071441
4-[2-(3,9-diazaspiro[5.5]undecan-3-ylmethyl)-6-(1H-indazol-4-yl)imidazo[1,2-a]pyrazin-8-yl]morpholine
CID 90067975
4-(4-propan-2-yl-1H-indazol-6-yl)morpholine
CID 167286378
[2-[[4-(4-chloro-5-pyrrolidin-1-yl-3-pyridinyl)triazol-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]methanol
CID 171084400
1-(1H-indazol-4-yl)-N-methyl-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]but-3-en-1-imine
CID 155702804
8-[[6-(1H-indazol-4-yl)-8-morpholin-4-ylimidazo[1,2-a]pyrazin-2-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one
CID 90067971

Frequently Asked Questions

What is the IUPAC name of 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine?
The IUPAC name of 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine (CID 175276114) is 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine.
What is the SMILES notation for 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine?
The canonical SMILES for 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine is Cc1ccc2nc(Cn3cc(-c4cc(N5CCOCC5)cc5[nH]ncc45)nn3)cn2c1.
What is the InChIKey of 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine?
The InChIKey is FGJDOICYJPJNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N8O/c1-15-2-3-22-24-16(12-29(22)11-15)13-30-14-21(26-27-30)18-8-17(28-4-6-31-7-5-28)9-20-19(18)10-23-25-20/h2-3,8-12,14H,4-7,13H2,1H3,(H,23,25).
What are the key properties of 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine?
4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine has a molecular weight of 414.47 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]triazol-4-yl]-1H-indazol-6-yl]morpholine is sourced from PubChem (CID 175276114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).