1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one

C17H24N4O2 — CID 16668407

IUPAC1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
SMILESCC1CCN(C(=O)Cn2c(=O)n(C(C)C)c3ncccc32)CC1
InChIInChI=1S/C17H24N4O2/c1-12(2)21-16-14(5-4-8-18-16)20(17(21)23)11-15(22)19-9-6-13(3)7-10-19/h4-5,8,12-13H,6-7,9-11H2,1-3H3
InChIKeyWNWZBWRTPIZIQQ-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.04
Rot. Bonds3

About 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one

1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one (PubChem CID 16668407) has the molecular formula C17H24N4O2 and a molecular weight of 316.40 g/mol. Its IUPAC name is 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
PubChem CID16668407
Molecular FormulaC17H24N4O2
Molecular Weight316.40 g/mol
Exact Mass316.19
IUPAC Name1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
SMILESCC1CCN(C(=O)Cn2c(=O)n(C(C)C)c3ncccc32)CC1
InChIInChI=1S/C17H24N4O2/c1-12(2)21-16-14(5-4-8-18-16)20(17(21)23)11-15(22)19-9-6-13(3)7-10-19/h4-5,8,12-13H,6-7,9-11H2,1-3H3
InChIKeyWNWZBWRTPIZIQQ-UHFFFAOYSA-N
XLogP2.04
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one with MolForge

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Related Compounds

1-[2-(2-oxo-3-propan-2-ylimidazo[4,5-b]pyridin-1-yl)acetyl]piperidine-4-carboxamide
CID 16669007
1-(2-oxo-2-piperidin-1-ylethyl)-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
CID 16667871
2-(2-oxo-3-propan-2-ylimidazo[4,5-b]pyridin-1-yl)acetic acid
CID 121199605
1-[2-(2,2-dimethyl-3-oxopiperazin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one
CID 16669009
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-oxo-3-propan-2-ylimidazo[4,5-b]pyridin-1-yl)acetamide
CID 95807337
3-methyl-8-[2-oxo-2-(4-propan-2-ylpiperazin-1-yl)ethyl]-2,4,5,8,13-pentazatricyclo[7.4.0.02,6]trideca-1(9),3,5,10,12-pentaen-7-one
CID 53149201
7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1,7-naphthyridin-8-one
CID 126837339
1-(4-methylpiperidin-1-yl)-2-(2-phenylbenzimidazol-1-yl)ethanone
CID 17000581
3-(4-ethylphenyl)-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]quinazoline-2,4-dione
CID 15995715
2-(3-cyclopentyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-propan-2-ylacetamide
CID 53159374
1-[2-(4-aminopiperidin-1-yl)-2-oxoethyl]-3-ethylbenzimidazol-2-one
CID 119374924
4-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-5-pyridin-2-yl-1,2,4-triazol-3-one
CID 121117019

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one (CID 16668407) is 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one is CC1CCN(C(=O)Cn2c(=O)n(C(C)C)c3ncccc32)CC1.
What is the InChIKey of 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one?
The InChIKey is WNWZBWRTPIZIQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-12(2)21-16-14(5-4-8-18-16)20(17(21)23)11-15(22)19-9-6-13(3)7-10-19/h4-5,8,12-13H,6-7,9-11H2,1-3H3.
What are the key properties of 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one?
1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one has a molecular weight of 316.40 g/mol, XLogP of 2.04, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3-propan-2-ylimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 16668407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).