1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one

C20H14N4O — CID 69251341

IUPAC1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)[nH]c2cnc3ccc(-c4cnc5ccccc5c4)cc3c21
InChIInChI=1S/C20H14N4O/c1-24-19-15-9-12(6-7-17(15)22-11-18(19)23-20(24)25)14-8-13-4-2-3-5-16(13)21-10-14/h2-11H,1H3,(H,23,25)
InChIKeyOBUTXLJFLQHAHH-UHFFFAOYSA-N
MW326.36 g/mol
LogP3.63
Rot. Bonds1

About 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one

1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one (PubChem CID 69251341) has the molecular formula C20H14N4O and a molecular weight of 326.36 g/mol. Its IUPAC name is 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one
PubChem CID69251341
Molecular FormulaC20H14N4O
Molecular Weight326.36 g/mol
Exact Mass326.12
IUPAC Name1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)[nH]c2cnc3ccc(-c4cnc5ccccc5c4)cc3c21
InChIInChI=1S/C20H14N4O/c1-24-19-15-9-12(6-7-17(15)22-11-18(19)23-20(24)25)14-8-13-4-2-3-5-16(13)21-10-14/h2-11H,1H3,(H,23,25)
InChIKeyOBUTXLJFLQHAHH-UHFFFAOYSA-N
XLogP3.63
TPSA63.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-(piperidin-4-ylmethyl)-8-quinolin-3-ylimidazo[4,5-c]quinolin-2-one
CID 77106932
4-methylbenzenesulfonic acid;3-methyl-1-naphthalen-2-yl-8-quinolin-3-ylimidazo[4,5-c]quinolin-2-one
CID 87185338
1-[4-(4-ethylpiperazin-1-yl)phenyl]-3-methyl-8-quinolin-3-ylimidazo[4,5-c]quinolin-2-one
CID 66846394
1-(1-methylpiperidin-4-yl)-8-quinolin-3-yl-3H-imidazo[4,5-c][1,5]naphthyridin-2-one
CID 91064337
2-methyl-2-[4-[2-oxo-8-quinolin-3-yl-3-(trideuteriomethyl)imidazo[4,5-c]quinolin-1-yl]phenyl]propanenitrile
CID 25207809
8-[6-amino-5-(trifluoromethyl)-3-pyridinyl]-3-methyl-4-quinolin-6-yl-1H-imidazo[4,5-c]quinolin-2-one
CID 123889208
3-methyl-1H-benzo[g]quinazoline-2,4-dione
CID 22960616
1-[4-[1-(2-hydroxypropanoyl)-3,6-dihydro-2H-pyridin-4-yl]phenyl]-3-methyl-8-quinolin-3-ylimidazo[4,5-c]quinolin-2-one
CID 90182390
8-phenyl-1-[3-(trifluoromethyl)phenyl]-3H-imidazo[4,5-c]quinolin-2-one
CID 127047610
3-[4-(4-fluorophenyl)phenyl]quinoline
CID 171056588
[1-(2,4-dimethoxyphenyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c]quinolin-2-ylidene]cyanamide
CID 56598041
3-quinolin-3-yl-1H-benzimidazol-2-one
CID 150795501

Frequently Asked Questions

What is the IUPAC name of 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one (CID 69251341) is 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one is Cn1c(=O)[nH]c2cnc3ccc(-c4cnc5ccccc5c4)cc3c21.
What is the InChIKey of 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one?
The InChIKey is OBUTXLJFLQHAHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O/c1-24-19-15-9-12(6-7-17(15)22-11-18(19)23-20(24)25)14-8-13-4-2-3-5-16(13)21-10-14/h2-11H,1H3,(H,23,25).
What are the key properties of 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one?
1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one has a molecular weight of 326.36 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 69251341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).