potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one

C11H13KN4O2 — CID 145302216

IUPACpotassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2ncccc2n1C1CCN([O-])CC1.[K+]
InChIInChI=1S/C11H13N4O2.K/c16-11-13-10-9(2-1-5-12-10)15(11)8-3-6-14(17)7-4-8;/h1-2,5,8H,3-4,6-7H2,(H,12,13,16);/q-1;+1
InChIKeyNIZIWLGUGMTQAN-UHFFFAOYSA-N
MW272.35 g/mol
LogP-2.14
Rot. Bonds1

About potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one

potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 145302216) has the molecular formula C11H13KN4O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Namepotassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID145302216
Molecular FormulaC11H13KN4O2
Molecular Weight272.35 g/mol
Exact Mass272.07
IUPAC Namepotassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESO=c1[nH]c2ncccc2n1C1CCN([O-])CC1.[K+]
InChIInChI=1S/C11H13N4O2.K/c16-11-13-10-9(2-1-5-12-10)15(11)8-3-6-14(17)7-4-8;/h1-2,5,8H,3-4,6-7H2,(H,12,13,16);/q-1;+1
InChIKeyNIZIWLGUGMTQAN-UHFFFAOYSA-N
XLogP-2.14
TPSA76.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 5-2.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethane;1-(1-methylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 143218186
ethane;4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbaldehyde
CID 142441053
potassium;hydride;4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxamide
CID 174628574
1-[1-(4-aminophenyl)piperidin-4-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 118888622
methylidyne-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carbonyl]azanium
CID 163491141
1-(azepan-4-yl)-3H-imidazo[4,5-b]pyridin-2-one
CID 170742162
1-(3-hydroxycyclobutyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 175822352
1-[1-(2-bromopyrimidin-4-yl)piperidin-4-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 58386482
ethyl 4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidine-1-carboxylate
CID 24885297
methyl 4-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidin-1-yl]piperidine-1-carboxylate
CID 22745299
2-[4-(2-oxo-3H-imidazo[4,5-b]pyridin-1-yl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 58386658
3-cyclopropyl-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 20751414

Frequently Asked Questions

What is the IUPAC name of potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one (CID 145302216) is potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one is O=c1[nH]c2ncccc2n1C1CCN([O-])CC1.[K+].
What is the InChIKey of potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is NIZIWLGUGMTQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N4O2.K/c16-11-13-10-9(2-1-5-12-10)15(11)8-3-6-14(17)7-4-8;/h1-2,5,8H,3-4,6-7H2,(H,12,13,16);/q-1;+1.
What are the key properties of potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one?
potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 272.35 g/mol, XLogP of -2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 1-(1-oxidopiperidin-4-yl)-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 145302216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).