8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one

C120H112Cl6F8N8O4 — CID 157336253

IUPAC8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one
SMILESCC(C)(C)N1CC=C(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(Cl)cccc4Cl)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1
InChIInChI=1S/C30H28Cl3FN2O.C30H28ClF3N2O.C30H29ClF2N2O.C30H27ClF2N2O/c1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(34)17-24(21)33)36-14-11-27(37)29(26(36)16-19)28-22(31)5-4-6-23(28)32;1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(32)17-22(21)31)36-14-11-27(37)29(26(36)16-19)28-23(33)5-4-6-24(28)34;2*1-30(2,3)34-14-11-19(12-15-34)20-17-25(21-7-4-5-8-22(21)31)35-16-13-27(36)29(26(35)18-20)28-23(32)9-6-10-24(28)33/h2*4-8,11,14-18H,9-10,12-13H2,1-3H3;4-10,13,16-19H,11-12,14-15H2,1-3H3;4-11,13,16-18H,12,14-15H2,1-3H3
InChIKeyBFWHPRZMUIHYAC-UHFFFAOYSA-N
MW2094.97 g/mol
LogP31.39
Rot. Bonds12

About 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one

8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one (PubChem CID 157336253) has the molecular formula C120H112Cl6F8N8O4 and a molecular weight of 2094.97 g/mol. Its IUPAC name is 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one.

Molecular Properties

Compound Name8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one
PubChem CID157336253
Molecular FormulaC120H112Cl6F8N8O4
Molecular Weight2094.97 g/mol
Exact Mass2090.68
IUPAC Name8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one
SMILESCC(C)(C)N1CC=C(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(Cl)cccc4Cl)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1
InChIInChI=1S/C30H28Cl3FN2O.C30H28ClF3N2O.C30H29ClF2N2O.C30H27ClF2N2O/c1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(34)17-24(21)33)36-14-11-27(37)29(26(36)16-19)28-22(31)5-4-6-23(28)32;1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(32)17-22(21)31)36-14-11-27(37)29(26(36)16-19)28-23(33)5-4-6-24(28)34;2*1-30(2,3)34-14-11-19(12-15-34)20-17-25(21-7-4-5-8-22(21)31)35-16-13-27(36)29(26(35)18-20)28-23(32)9-6-10-24(28)33/h2*4-8,11,14-18H,9-10,12-13H2,1-3H3;4-10,13,16-19H,11-12,14-15H2,1-3H3;4-11,13,16-18H,12,14-15H2,1-3H3
InChIKeyBFWHPRZMUIHYAC-UHFFFAOYSA-N
XLogP31.39
TPSA98.88 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002094.97
LogP ≤ 531.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one with MolForge

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Related Compounds

7-(1-tert-butylpiperidin-4-yl)-5-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolin-2-one
CID 23532696
7-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-1-(2-chloro-6-methylphenyl)-5-(2,4-difluorophenyl)quinolin-2-one
CID 142155828
7-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-1,6-naphthyridin-2-one;hydrochloride
CID 173220690
7-(1-tert-butylpiperidin-4-yl)-5-(2,4-difluorophenyl)-1-(2,6-difluorophenyl)quinolin-2-one
CID 23532649
7-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-5-(2-chloro-4-phosphanylphenyl)-1-(2,6-dichlorophenyl)quinolin-2-one
CID 142155881
2-(1-tert-butylpiperidin-4-yl)-4-(2-chloro-4-fluorophenyl)-8-(2,6-dichlorophenyl)-1,7-naphthyridine
CID 91047032
7-(1-tert-butylpiperidin-4-yl)-1-(2,6-dichlorophenyl)-5-(3,4-difluorophenyl)quinolin-2-one
CID 23532577
7-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-1,5-dimethylquinolin-2-one
CID 23532589
3-chloro-5-cyclopropyl-7-(3-fluorophenyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid
CID 67112297
1-tert-butyl-4-(3-methylphenyl)piperidine
CID 158482737
7-[1-tert-butyl-4-(hydroxymethyl)piperidin-4-yl]-5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-1,8-naphthyridin-2-one;7-(1-tert-butylpiperidin-4-yl)-5-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)-1,8-naphthyridin-2-one;7-(1-tert-butylpiperidin-4-yl)-1-(2,6-dichlorophenyl)-5-(2-fluorophenyl)-1,8-naphthyridin-2-one;7-(1-tert-butylpiperidin-4-yl)-1-(2,6-dichlorophenyl)-5-phenyl-1,8-naphthyridin-2-one
CID 159139554
7-(1-tert-butylpiperidin-4-yl)-1-(2,6-dichlorophenyl)-5-(3-phosphanylphenyl)quinolin-2-one
CID 142155920

Frequently Asked Questions

What is the IUPAC name of 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one?
The IUPAC name of 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one (CID 157336253) is 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one.
What is the SMILES notation for 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one?
The canonical SMILES for 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one is CC(C)(C)N1CC=C(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(Cl)cccc4Cl)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccc(F)cc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.CC(C)(C)N1CCC(c2cc(-c3ccccc3Cl)n3ccc(=O)c(-c4c(F)cccc4F)c3c2)CC1.
What is the InChIKey of 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one?
The InChIKey is BFWHPRZMUIHYAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28Cl3FN2O.C30H28ClF3N2O.C30H29ClF2N2O.C30H27ClF2N2O/c1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(34)17-24(21)33)36-14-11-27(37)29(26(36)16-19)28-22(31)5-4-6-23(28)32;1-30(2,3)35-12-9-18(10-13-35)19-15-25(21-8-7-20(32)17-22(21)31)36-14-11-27(37)29(26(36)16-19)28-23(33)5-4-6-24(28)34;2*1-30(2,3)34-14-11-19(12-15-34)20-17-25(21-7-4-5-8-22(21)31)35-16-13-27(36)29(26(35)18-20)28-23(32)9-6-10-24(28)33/h2*4-8,11,14-18H,9-10,12-13H2,1-3H3;4-10,13,16-19H,11-12,14-15H2,1-3H3;4-11,13,16-18H,12,14-15H2,1-3H3.
What are the key properties of 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one?
8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one has a molecular weight of 2094.97 g/mol, XLogP of 31.39, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(1-tert-butyl-3,6-dihydro-2H-pyridin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-dichlorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chloro-4-fluorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one;8-(1-tert-butylpiperidin-4-yl)-6-(2-chlorophenyl)-1-(2,6-difluorophenyl)quinolizin-2-one is sourced from PubChem (CID 157336253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).