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

C23H18N4O — CID 24984680

IUPAC3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one
SMILESCC(c1ccccc1)n1c(=O)[nH]c2ccc(-c3cccc4ncccc34)nc21
InChIInChI=1S/C23H18N4O/c1-15(16-7-3-2-4-8-16)27-22-21(26-23(27)28)13-12-20(25-22)18-9-5-11-19-17(18)10-6-14-24-19/h2-15H,1H3,(H,26,28)
InChIKeyLFUAZCRRROSASB-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.55
Rot. Bonds3

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

3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one (PubChem CID 24984680) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one
PubChem CID24984680
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one
SMILESCC(c1ccccc1)n1c(=O)[nH]c2ccc(-c3cccc4ncccc34)nc21
InChIInChI=1S/C23H18N4O/c1-15(16-7-3-2-4-8-16)27-22-21(26-23(27)28)13-12-20(25-22)18-9-5-11-19-17(18)10-6-14-24-19/h2-15H,1H3,(H,26,28)
InChIKeyLFUAZCRRROSASB-UHFFFAOYSA-N
XLogP4.55
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-[(1R)-1-phenylethyl]-5-quinolin-5-ylimidazo[4,5-b]pyrazin-2-one
CID 66699767
3-[1-(4-methoxyphenyl)ethyl]-5-quinolin-5-yl-1H-imidazo[4,5-b]pyrazin-2-one
CID 66699691
3-benzhydryl-5-quinolin-5-yl-1H-imidazo[4,5-b]pyrazin-2-one
CID 24984854
3-[(1R)-1-phenylpropyl]-5-quinolin-5-yl-1H-imidazo[4,5-b]pyrazin-2-one
CID 66699594
5-[3-[(1R)-1-phenylethyl]-1,2-dihydroimidazo[4,5-b]pyridin-5-yl]quinoline
CID 91137046
3-quinolin-5-yl-1H-benzimidazol-2-one
CID 146175427
5-(3-hydroxyphenyl)-3-[(1R)-1-phenylethyl]-1H-imidazo[4,5-b]pyrazin-2-one
CID 126475662
3-[1-(4-chlorophenyl)ethyl]-5-[1-(4-methylsulfonylphenyl)-2-quinolin-5-ylethyl]-1H-imidazo[4,5-b]pyrazin-2-one
CID 67318843
N-(1-phenylethyl)quinolin-5-amine
CID 43177987
2-(benzimidazol-1-yl)-9-[1-(3-fluorophenyl)ethyl]-7H-purin-8-one
CID 59846486
(2R)-3-methyl-2-(5-quinolin-5-ylimidazo[4,5-b]pyrazin-3-yl)butan-1-ol
CID 141358659
5-(2-methoxypyrimidin-5-yl)-3-[(1S)-1-phenylethyl]-1H-imidazo[4,5-b]pyrazin-2-one
CID 126472296

Frequently Asked Questions

What is the IUPAC name of 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one (CID 24984680) is 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one is CC(c1ccccc1)n1c(=O)[nH]c2ccc(-c3cccc4ncccc34)nc21.
What is the InChIKey of 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is LFUAZCRRROSASB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c1-15(16-7-3-2-4-8-16)27-22-21(26-23(27)28)13-12-20(25-22)18-9-5-11-19-17(18)10-6-14-24-19/h2-15H,1H3,(H,26,28).
What are the key properties of 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one?
3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 366.42 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-phenylethyl)-5-quinolin-5-yl-1H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 24984680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).