5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C15H16N4O — CID 20556193

IUPAC5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESCC(C)(C)c1nc2[nH]c(=O)[nH]c2cc1-c1ccncc1
InChIInChI=1S/C15H16N4O/c1-15(2,3)12-10(9-4-6-16-7-5-9)8-11-13(18-12)19-14(20)17-11/h4-8H,1-3H3,(H2,17,18,19,20)
InChIKeyZWQTYRVICRSQSJ-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.61
Rot. Bonds1

About 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one

5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 20556193) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID20556193
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESCC(C)(C)c1nc2[nH]c(=O)[nH]c2cc1-c1ccncc1
InChIInChI=1S/C15H16N4O/c1-15(2,3)12-10(9-4-6-16-7-5-9)8-11-13(18-12)19-14(20)17-11/h4-8H,1-3H3,(H2,17,18,19,20)
InChIKeyZWQTYRVICRSQSJ-UHFFFAOYSA-N
XLogP2.61
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-tert-butyl-3-nitro-5-pyridin-4-ylpyridin-2-amine
CID 20556142
5-(2-methyl-4-pyridinyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 20550354
aluminum tris(6-(2-hydroxyphenyl)-5-phenyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one)
CID 175810779
2-tert-butyl-4-(4-methyl-3-pyridinyl)-1H-pyrimidin-6-one
CID 136955614
4-(3,7-ditert-butyl-5-pyridin-4-ylnaphthalen-1-yl)pyridine
CID 169050144
6-chloro-5-methyl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 144579589
5-tert-butyl-2-pyridin-4-yl-1H-indole
CID 131887138
6-methyl-3-(2-pyridin-4-yl-1,3-thiazol-4-yl)-1H-pyridin-2-one
CID 10355730
6-chloro-5-[4-(2-fluorophenyl)phenyl]-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 138567693
5-[2-oxo-2-(2-pyridin-4-ylphenyl)ethyl]-1,3-dihydrobenzimidazol-2-one
CID 159840558
1,3-dihydroimidazo[4,5-c]pyridin-2-one
CID 11686916
5-propan-2-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one
CID 118259570

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 20556193) is 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is CC(C)(C)c1nc2[nH]c(=O)[nH]c2cc1-c1ccncc1.
What is the InChIKey of 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is ZWQTYRVICRSQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-15(2,3)12-10(9-4-6-16-7-5-9)8-11-13(18-12)19-14(20)17-11/h4-8H,1-3H3,(H2,17,18,19,20).
What are the key properties of 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 268.32 g/mol, XLogP of 2.61, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-6-pyridin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 20556193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).