1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one

C17H26N4O — CID 71136197

IUPAC1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one
SMILESCn1c(=O)n(CC(C)(C)C)c2ccc(C3CCCNC3)nc21
InChIInChI=1S/C17H26N4O/c1-17(2,3)11-21-14-8-7-13(12-6-5-9-18-10-12)19-15(14)20(4)16(21)22/h7-8,12,18H,5-6,9-11H2,1-4H3
InChIKeyGRJALPAUTWLGGU-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.25
Rot. Bonds2

About 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one

1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one (PubChem CID 71136197) has the molecular formula C17H26N4O and a molecular weight of 302.42 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one
PubChem CID71136197
Molecular FormulaC17H26N4O
Molecular Weight302.42 g/mol
Exact Mass302.21
IUPAC Name1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one
SMILESCn1c(=O)n(CC(C)(C)C)c2ccc(C3CCCNC3)nc21
InChIInChI=1S/C17H26N4O/c1-17(2,3)11-21-14-8-7-13(12-6-5-9-18-10-12)19-15(14)20(4)16(21)22/h7-8,12,18H,5-6,9-11H2,1-4H3
InChIKeyGRJALPAUTWLGGU-UHFFFAOYSA-N
XLogP2.25
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(1-acetylpiperidin-3-yl)-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one
CID 71475565
benzyl-[3-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]cyclohexyl]carbamic acid
CID 135220791
1-(2,2-dimethylpropyl)-3-methyl-5-(6-methyl-2-azabicyclo[2.2.2]oct-5-en-5-yl)imidazo[4,5-b]pyridin-2-one
CID 71135235
1-(2,2-dimethylpropyl)-3-methyl-5-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]imidazo[4,5-b]pyridin-2-one
CID 71116752
5-(5-azatricyclo[5.4.0.01,6]undeca-2,4,8-trien-10-yl)-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one
CID 123220377
5-[1-[(5-chloro-2,1,3-benzoxadiazol-4-yl)sulfonyl]piperidin-3-yl]-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one
CID 71116765
1-(2,2-dimethylpropyl)-3-methyl-5-[1-[(4-methyl-2,3-dihydro-1,4-benzoxazin-7-yl)sulfonyl]piperidin-3-yl]imidazo[4,5-b]pyridin-2-one
CID 71116918
1-(2,2-dimethylpropyl)-3-methyl-5-[1-[(6-morpholin-4-yl-3-pyridinyl)sulfonyl]piperidin-3-yl]imidazo[4,5-b]pyridin-2-one
CID 71116744
N-[5-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-2,2-dimethylcyclohexyl]-1H-1,2,4-triazole-5-carboxamide
CID 71116975
1-(2,2-dimethylbutyl)-3-methyl-5-(3-pyrazol-1-ylcyclohexa-2,4-dien-1-yl)imidazo[4,5-b]pyridin-2-one
CID 123409650
N-[5-[1-(2,2-dimethylpropyl)-3-methyl-2-oxoimidazo[4,5-b]pyridin-5-yl]-2,2-dimethylcyclohexyl]-2-pyridin-2-ylacetamide
CID 71117105
5-[6-(dimethylamino)-3-pyridinyl]-1-(2,2-dimethylpropyl)-3-methylimidazo[4,5-b]pyridin-2-one
CID 54761749

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one (CID 71136197) is 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one is Cn1c(=O)n(CC(C)(C)C)c2ccc(C3CCCNC3)nc21.
What is the InChIKey of 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one?
The InChIKey is GRJALPAUTWLGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4O/c1-17(2,3)11-21-14-8-7-13(12-6-5-9-18-10-12)19-15(14)20(4)16(21)22/h7-8,12,18H,5-6,9-11H2,1-4H3.
What are the key properties of 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one?
1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one has a molecular weight of 302.42 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-3-methyl-5-piperidin-3-ylimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 71136197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).