8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline

C156H174BrCl3F3N13O2 — CID 160971469

IUPAC8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline
SMILESCC(C)c1cc(Br)c2ncccc2c1.CC(C)c1cc(Cl)c2nccc(C(C)C)c2c1.CC(C)c1cc(Cl)c2nccc(C(F)(F)F)c2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1cnc2ccccc2c1.COc1cc(C(C)C)cc2cccnc12.COc1ccnc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2ncccc12.Cc1cc(C)c2cc(C(C)C)cc(Cl)c2n1.Cc1cc2ncccc2cc1C(C)C.Cc1ccnc2c(C)cc(C(C)C)cc12.Cc1ccnc2ccc(C(C)C)cc12
InChIInChI=1S/C15H18ClN.C14H16ClN.C14H17N.C13H11ClF3N.2C13H15NO.3C13H15N.C12H12BrN.C12H13N.C11H12N2/c1-9(2)11-7-13-12(10(3)4)5-6-17-15(13)14(16)8-11;1-8(2)11-6-12-9(3)5-10(4)16-14(12)13(15)7-11;1-9(2)12-7-11(4)14-13(8-12)10(3)5-6-15-14;1-7(2)8-5-9-10(13(15,16)17)3-4-18-12(9)11(14)6-8;1-9(2)10-4-5-12-11(8-10)13(15-3)6-7-14-12;1-9(2)11-7-10-5-4-6-14-13(10)12(8-11)15-3;1-9(2)11-4-5-13-12(8-11)10(3)6-7-14-13;1-9(2)11-6-7-13-12(10(11)3)5-4-8-14-13;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10;1-9(2)11-7-10-5-3-4-6-12(10)13-8-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10/h5-10H,1-4H3;5-8H,1-4H3;5-9H,1-4H3;3-7H,1-2H3;2*4-9H,1-3H3;3*4-9H,1-3H3;3-8H,1-2H3;3-9H,1-2H3;3-8H,1-2H3
InChIKeySYHQUJVIXYEOBB-UHFFFAOYSA-N
MW2506.45 g/mol
LogP46.73
Rot. Bonds15

About 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline

8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline (PubChem CID 160971469) has the molecular formula C156H174BrCl3F3N13O2 and a molecular weight of 2506.45 g/mol. Its IUPAC name is 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline.

Molecular Properties

Compound Name8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline
PubChem CID160971469
Molecular FormulaC156H174BrCl3F3N13O2
Molecular Weight2506.45 g/mol
Exact Mass2502.21
IUPAC Name8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline
SMILESCC(C)c1cc(Br)c2ncccc2c1.CC(C)c1cc(Cl)c2nccc(C(C)C)c2c1.CC(C)c1cc(Cl)c2nccc(C(F)(F)F)c2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1cnc2ccccc2c1.COc1cc(C(C)C)cc2cccnc12.COc1ccnc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2ncccc12.Cc1cc(C)c2cc(C(C)C)cc(Cl)c2n1.Cc1cc2ncccc2cc1C(C)C.Cc1ccnc2c(C)cc(C(C)C)cc12.Cc1ccnc2ccc(C(C)C)cc12
InChIInChI=1S/C15H18ClN.C14H16ClN.C14H17N.C13H11ClF3N.2C13H15NO.3C13H15N.C12H12BrN.C12H13N.C11H12N2/c1-9(2)11-7-13-12(10(3)4)5-6-17-15(13)14(16)8-11;1-8(2)11-6-12-9(3)5-10(4)16-14(12)13(15)7-11;1-9(2)12-7-11(4)14-13(8-12)10(3)5-6-15-14;1-7(2)8-5-9-10(13(15,16)17)3-4-18-12(9)11(14)6-8;1-9(2)10-4-5-12-11(8-10)13(15-3)6-7-14-12;1-9(2)11-7-10-5-4-6-14-13(10)12(8-11)15-3;1-9(2)11-4-5-13-12(8-11)10(3)6-7-14-13;1-9(2)11-6-7-13-12(10(11)3)5-4-8-14-13;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10;1-9(2)11-7-10-5-3-4-6-12(10)13-8-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10/h5-10H,1-4H3;5-8H,1-4H3;5-9H,1-4H3;3-7H,1-2H3;2*4-9H,1-3H3;3*4-9H,1-3H3;3-8H,1-2H3;3-9H,1-2H3;3-8H,1-2H3
InChIKeySYHQUJVIXYEOBB-UHFFFAOYSA-N
XLogP46.73
TPSA186.03 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002506.45
LogP ≤ 546.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline with MolForge

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Related Compounds

8-Bromo-4-methyl-6-propan-2-ylquinoline;8-chloro-4,5-dimethyl-6-propan-2-ylquinoline;8-chloro-5-methyl-4,6-di(propan-2-yl)quinoline;4-chloro-8-methyl-6-propan-2-ylquinoline;8-chloro-4-methyl-6-propan-2-ylquinoline;8-chloro-5-methyl-6-propan-2-ylquinoline;8-chloro-5-methyl-6-propan-2-yl-4-(trifluoromethyl)quinoline;8-chloro-2,4,5-trimethyl-6-propan-2-ylquinoline;4,8-dimethyl-6-propan-2-ylquinoline;8-methoxy-4-methyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;8-methyl-6-propan-2-ylquinoline
CID 157425637
8-Chloro-6-methylquinoline;2,4-dimethylquinoline;6,8-dimethylquinoline;8-methoxy-6-methylquinoline;5-methylquinoline;6-methylquinoline;6-methyl-8-(trifluoromethyl)quinoline
CID 158273275
8-Chloro-6-methylquinoline;2,4-dimethylquinoline;6,8-dimethylquinoline;8-methoxy-6-methylquinoline;1-methyl-4-nitrobenzene;2-methylpyridine;3-methylpyridine;4-methylpyridine;5-methylquinoline;6-methylquinoline;6-methyl-8-(trifluoromethyl)quinoline;1,4-xylene
CID 159020483
8-Bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-5-methyl-6-propan-2-yl-4-(trifluoromethyl)quinoline;8-chloro-6-propan-2-ylquinazoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;6-propan-2-yl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;2-propan-2-yl-1,5-naphthyridine;3-propan-2-yl-1,8-naphthyridine;6-propan-2-ylquinazoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-1,2,3,4-tetrahydroquinoline;6-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 160480085
8-Bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,5-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;2-propan-2-yl-1,5-naphthyridine;3-propan-2-yl-1,8-naphthyridine;6-propan-2-ylquinazoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline
CID 165049876
8-Bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,5-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;4-chloro-8-methyl-6-propan-2-ylquinoline;8-chloro-4-methyl-6-propan-2-ylquinoline;8-chloro-5-methyl-6-propan-2-ylquinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;8-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline
CID 167646130
7-(3-Bromo-4-piperidin-1-ylphenyl)-5-chloro-1,6-naphthyridine;5-chloro-7-(3-methoxy-4-piperidin-1-ylphenyl)-1,6-naphthyridine;5-chloro-7-[4-(4-methylpiperazin-1-yl)phenyl]-1,6-naphthyridine;5-chloro-7-(3-methyl-4-piperidin-1-ylphenyl)-1,6-naphthyridine;5-chloro-7-(4-piperidin-1-ylphenyl)-1,6-naphthyridine;methane
CID 161078159
Bis(8-chloro-6-propan-2-ylquinoline);2-methoxy-6-propan-2-ylquinoline;2-methyl-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;6-propan-2-ylisoquinoline;2-propan-2-yl-1,5-naphthyridine;3-propan-2-ylquinoline;6-propan-2-ylquinoline;6-propan-2-ylquinoxaline
CID 165025563

Frequently Asked Questions

What is the IUPAC name of 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline?
The IUPAC name of 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline (CID 160971469) is 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline.
What is the SMILES notation for 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline?
The canonical SMILES for 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline is CC(C)c1cc(Br)c2ncccc2c1.CC(C)c1cc(Cl)c2nccc(C(C)C)c2c1.CC(C)c1cc(Cl)c2nccc(C(F)(F)F)c2c1.CC(C)c1ccc2nccnc2c1.CC(C)c1cnc2ccccc2c1.COc1cc(C(C)C)cc2cccnc12.COc1ccnc2ccc(C(C)C)cc12.Cc1c(C(C)C)ccc2ncccc12.Cc1cc(C)c2cc(C(C)C)cc(Cl)c2n1.Cc1cc2ncccc2cc1C(C)C.Cc1ccnc2c(C)cc(C(C)C)cc12.Cc1ccnc2ccc(C(C)C)cc12.
What is the InChIKey of 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline?
The InChIKey is SYHQUJVIXYEOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClN.C14H16ClN.C14H17N.C13H11ClF3N.2C13H15NO.3C13H15N.C12H12BrN.C12H13N.C11H12N2/c1-9(2)11-7-13-12(10(3)4)5-6-17-15(13)14(16)8-11;1-8(2)11-6-12-9(3)5-10(4)16-14(12)13(15)7-11;1-9(2)12-7-11(4)14-13(8-12)10(3)5-6-15-14;1-7(2)8-5-9-10(13(15,16)17)3-4-18-12(9)11(14)6-8;1-9(2)10-4-5-12-11(8-10)13(15-3)6-7-14-12;1-9(2)11-7-10-5-4-6-14-13(10)12(8-11)15-3;1-9(2)11-4-5-13-12(8-11)10(3)6-7-14-13;1-9(2)11-6-7-13-12(10(11)3)5-4-8-14-13;1-9(2)12-8-11-5-4-6-14-13(11)7-10(12)3;1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10;1-9(2)11-7-10-5-3-4-6-12(10)13-8-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10/h5-10H,1-4H3;5-8H,1-4H3;5-9H,1-4H3;3-7H,1-2H3;2*4-9H,1-3H3;3*4-9H,1-3H3;3-8H,1-2H3;3-9H,1-2H3;3-8H,1-2H3.
What are the key properties of 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline?
8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline has a molecular weight of 2506.45 g/mol, XLogP of 46.73, 15 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-6-propan-2-ylquinoline;8-chloro-2,4-dimethyl-6-propan-2-ylquinoline;8-chloro-4,6-di(propan-2-yl)quinoline;8-chloro-6-propan-2-yl-4-(trifluoromethyl)quinoline;4,8-dimethyl-6-propan-2-ylquinoline;4-methoxy-6-propan-2-ylquinoline;8-methoxy-6-propan-2-ylquinoline;4-methyl-6-propan-2-ylquinoline;5-methyl-6-propan-2-ylquinoline;7-methyl-6-propan-2-ylquinoline;3-propan-2-ylquinoline;6-propan-2-ylquinoxaline is sourced from PubChem (CID 160971469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).