1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol

C21H24N6O — CID 59640241

IUPAC1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol
SMILESCc1nc2nc(N)cc(-c3cc4cc(CN5CCCC(O)C5)ccc4[nH]3)c2[nH]1
InChIInChI=1S/C21H24N6O/c1-12-23-20-16(9-19(22)26-21(20)24-12)18-8-14-7-13(4-5-17(14)25-18)10-27-6-2-3-15(28)11-27/h4-5,7-9,15,25,28H,2-3,6,10-11H2,1H3,(H3,22,23,24,26)
InChIKeyRAJXWLUWUNOLFG-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.95
Rot. Bonds3

About 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol

1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol (PubChem CID 59640241) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol
PubChem CID59640241
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol
SMILESCc1nc2nc(N)cc(-c3cc4cc(CN5CCCC(O)C5)ccc4[nH]3)c2[nH]1
InChIInChI=1S/C21H24N6O/c1-12-23-20-16(9-19(22)26-21(20)24-12)18-8-14-7-13(4-5-17(14)25-18)10-27-6-2-3-15(28)11-27/h4-5,7-9,15,25,28H,2-3,6,10-11H2,1H3,(H3,22,23,24,26)
InChIKeyRAJXWLUWUNOLFG-UHFFFAOYSA-N
XLogP2.95
TPSA106.85 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol with MolForge

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Launch Full Analysis

Related Compounds

1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-4-one
CID 59640283
ethane;2-methyl-7-[6-(morpholin-4-ylmethyl)-1H-indol-2-yl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 142263154
4-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl-methylamino]-2,2,6,6-tetramethylcyclohexan-1-one
CID 59640040
7-[6-[[cyclopentyl(methyl)amino]methyl]-1H-indol-2-yl]-2-[[7-[6-[[cyclopentyl(methyl)amino]methyl]-1H-indol-2-yl]-2-[[2-methyl-7-[5-(piperidin-1-ylmethyl)-1H-indol-2-yl]-1H-imidazo[4,5-b]pyridin-5-yl]methyl]-1H-imidazo[4,5-b]pyridin-6-yl]methyl]-1H-imidazo[4,5-b]pyridin-5-amine
CID 142923698
3-(methylideneamino)-4-[5-(pyrrolidin-1-ylmethyl)-1H-indol-2-yl]pyridine-2,6-diamine
CID 142263038
2-methyl-7-[5-[(2-methylaziridin-1-yl)methyl]-1H-indol-2-yl]-1H-imidazo[4,5-b]pyridine
CID 59640083
3-[5-[(3-hydroxypyrrolidin-1-yl)methyl]-1H-indol-2-yl]-1H-quinolin-2-one
CID 22668265
1-[(6-amino-3-pyridinyl)methyl]piperidin-3-ol
CID 62207915
5-methyl-7-[5-(piperidin-1-ylmethyl)-1H-indol-2-yl]-2H-isoindol-4-ol
CID 69293865
(3S)-1-[(4-ethylphenyl)methyl]piperidin-3-ol
CID 27055523
3-[5-[(3-aminopyrrolidin-1-yl)methyl]-1H-indol-2-yl]-1H-quinolin-2-one
CID 22668304
1-[(3-methylphenyl)methyl]piperidin-3-ol
CID 23792038

Frequently Asked Questions

What is the IUPAC name of 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol?
The IUPAC name of 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol (CID 59640241) is 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol.
What is the SMILES notation for 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol?
The canonical SMILES for 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol is Cc1nc2nc(N)cc(-c3cc4cc(CN5CCCC(O)C5)ccc4[nH]3)c2[nH]1.
What is the InChIKey of 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol?
The InChIKey is RAJXWLUWUNOLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-12-23-20-16(9-19(22)26-21(20)24-12)18-8-14-7-13(4-5-17(14)25-18)10-27-6-2-3-15(28)11-27/h4-5,7-9,15,25,28H,2-3,6,10-11H2,1H3,(H3,22,23,24,26).
What are the key properties of 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol?
1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol has a molecular weight of 376.46 g/mol, XLogP of 2.95, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-(5-amino-2-methyl-1H-imidazo[4,5-b]pyridin-7-yl)-1H-indol-5-yl]methyl]piperidin-3-ol is sourced from PubChem (CID 59640241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).