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

C19H20N6O — CID 162659728

IUPAC3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(C2CCNCC2)c2c3cc(-c4cn[nH]c4)ccc3ncc21
InChIInChI=1S/C19H20N6O/c1-24-17-11-21-16-3-2-12(13-9-22-23-10-13)8-15(16)18(17)25(19(24)26)14-4-6-20-7-5-14/h2-3,8-11,14,20H,4-7H2,1H3,(H,22,23)
InChIKeyUOPLJORCWHLJBN-UHFFFAOYSA-N
MW348.41 g/mol
LogP2.20
Rot. Bonds2

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

3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (PubChem CID 162659728) has the molecular formula C19H20N6O and a molecular weight of 348.41 g/mol. Its IUPAC name is 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.

Molecular Properties

Compound Name3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
PubChem CID162659728
Molecular FormulaC19H20N6O
Molecular Weight348.41 g/mol
Exact Mass348.17
IUPAC Name3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one
SMILESCn1c(=O)n(C2CCNCC2)c2c3cc(-c4cn[nH]c4)ccc3ncc21
InChIInChI=1S/C19H20N6O/c1-24-17-11-21-16-3-2-12(13-9-22-23-10-13)8-15(16)18(17)25(19(24)26)14-4-6-20-7-5-14/h2-3,8-11,14,20H,4-7H2,1H3,(H,22,23)
InChIKeyUOPLJORCWHLJBN-UHFFFAOYSA-N
XLogP2.20
TPSA80.53 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Camizestrant
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Ko-947
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1-[3-(2-Methylpyridin-4-Yl)-1~{h}-Pyrazolo[4,3-C]pyridin-6-Yl]-3-(Phenylmethyl)urea
CID 71555247
6-[(6~{S},8~{R})-7-[(1-fluoranylcyclopropyl)methyl]-8-methyl-2,6,8,9-tetrahydropyrazolo[4,3-f]isoquinolin-6-yl]-~{N}-[1-(3-fluoranylpropyl)azetidin-3-yl]pyridin-3-amine
CID 134453448
1-{1-[(4-{7-phenyl-1H-pyrazolo[3,4-g]quinoxalin-6-yl}phenyl)methyl]piperidin-4-yl}-2,3-dihydro-1H-1,3-benzodiazol-2-one
CID 10289671
1-(2-{4-[1-(4-Fluoro-phenyl)-5-(1-methyl-1H-pyrazol-3-yl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one
CID 11049209
1-(2-{4-[1-(4-Fluoro-phenyl)-5-(2H-[1,2,3]triazol-4-yl)-1H-indol-3-yl]-piperidin-1-yl}-ethyl)-imidazolidin-2-one
CID 11123573
N-[1-[1-[(4-tert-butylphenyl)methyl]imidazol-2-yl]-2-(7-methyl-1H-indazol-5-yl)ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
CID 11204498
(+/-)-N-(1-(6-Bromopyridin-2-yl)-2-(7-methyl-1H-indazol-5-yl)ethyl)-4-(2-oxo-1,2-dihydroquinazolin-3(4H)-yl)piperidine-1-carboxamide
CID 11215446
N-[2-(7-methyl-1H-indazol-5-yl)-1-[1-(pyridin-3-ylmethyl)imidazol-2-yl]ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
CID 11238677
N-[1-[1-[(3-fluorophenyl)methyl]imidazol-2-yl]-2-(7-methyl-1H-indazol-5-yl)ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
CID 11250445
N-[1-[1-[(4-fluorophenyl)methyl]imidazol-2-yl]-2-(7-methyl-1H-indazol-5-yl)ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
CID 11250446

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The IUPAC name of 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one (CID 162659728) is 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one.
What is the SMILES notation for 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The canonical SMILES for 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is Cn1c(=O)n(C2CCNCC2)c2c3cc(-c4cn[nH]c4)ccc3ncc21.
What is the InChIKey of 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
The InChIKey is UOPLJORCWHLJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O/c1-24-17-11-21-16-3-2-12(13-9-22-23-10-13)8-15(16)18(17)25(19(24)26)14-4-6-20-7-5-14/h2-3,8-11,14,20H,4-7H2,1H3,(H,22,23).
What are the key properties of 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one?
3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one has a molecular weight of 348.41 g/mol, XLogP of 2.20, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-piperidin-4-yl-8-(1H-pyrazol-4-yl)imidazo[4,5-c]quinolin-2-one is sourced from PubChem (CID 162659728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).