8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one

C191H202ClF2N9O5 — CID 159539298

IUPAC8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one
SMILESCC(CCCc1cccc2cccnc12)c1ccccc1Cl.CCC(CC(=O)Cc1cccc2cccnc12)c1ccccc1OC.CCC(CCCc1cccc2cccnc12)c1ccccc1OC.Cc1ccc(C(C)CC(=O)Cc2ccc3ncccc3c2)cc1.Cc1ccccc1C(C)C(C)CCc1cccc2cccnc12.Cc1ccccc1C(C)C(F)C(=O)Cc1cccc2cccnc12.Cc1ccccc1C(C)C(F)CCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12
InChIInChI=1S/C22H23NO2.C22H25NO.C22H25N.C21H20FNO.C21H22FN.C21H21NO.2C21H23N.C20H20ClN/c1-3-16(20-11-4-5-12-21(20)25-2)14-19(24)15-18-9-6-8-17-10-7-13-23-22(17)18;1-3-17(20-14-4-5-15-21(20)24-2)9-6-10-18-11-7-12-19-13-8-16-23-22(18)19;1-16(18(3)21-12-5-4-8-17(21)2)13-14-20-10-6-9-19-11-7-15-23-22(19)20;1-14-7-3-4-11-18(14)15(2)20(22)19(24)13-17-9-5-8-16-10-6-12-23-21(16)17;1-15-7-3-4-11-19(15)16(2)20(22)13-12-18-9-5-8-17-10-6-14-23-21(17)18;1-15-5-8-18(9-6-15)16(2)12-20(23)14-17-7-10-21-19(13-17)4-3-11-22-21;2*1-16-8-3-4-14-20(16)17(2)9-5-10-18-11-6-12-19-13-7-15-22-21(18)19;1-15(18-12-2-3-13-19(18)21)7-4-8-16-9-5-10-17-11-6-14-22-20(16)17/h4-13,16H,3,14-15H2,1-2H3;4-5,7-8,11-17H,3,6,9-10H2,1-2H3;4-12,15-16,18H,13-14H2,1-3H3;3-12,15,20H,13H2,1-2H3;3-11,14,16,20H,12-13H2,1-2H3;3-11,13,16H,12,14H2,1-2H3;2*3-4,6-8,11-15,17H,5,9-10H2,1-2H3;2-3,5-6,9-15H,4,7-8H2,1H3
InChIKeyMDZKUQAIKSHPBM-UHFFFAOYSA-N
MW2777.22 g/mol
LogP49.23
Rot. Bonds49

About 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one

8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one (PubChem CID 159539298) has the molecular formula C191H202ClF2N9O5 and a molecular weight of 2777.22 g/mol. Its IUPAC name is 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one.

Molecular Properties

Compound Name8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one
PubChem CID159539298
Molecular FormulaC191H202ClF2N9O5
Molecular Weight2777.22 g/mol
Exact Mass2774.55
IUPAC Name8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one
SMILESCC(CCCc1cccc2cccnc12)c1ccccc1Cl.CCC(CC(=O)Cc1cccc2cccnc12)c1ccccc1OC.CCC(CCCc1cccc2cccnc12)c1ccccc1OC.Cc1ccc(C(C)CC(=O)Cc2ccc3ncccc3c2)cc1.Cc1ccccc1C(C)C(C)CCc1cccc2cccnc12.Cc1ccccc1C(C)C(F)C(=O)Cc1cccc2cccnc12.Cc1ccccc1C(C)C(F)CCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12
InChIInChI=1S/C22H23NO2.C22H25NO.C22H25N.C21H20FNO.C21H22FN.C21H21NO.2C21H23N.C20H20ClN/c1-3-16(20-11-4-5-12-21(20)25-2)14-19(24)15-18-9-6-8-17-10-7-13-23-22(17)18;1-3-17(20-14-4-5-15-21(20)24-2)9-6-10-18-11-7-12-19-13-8-16-23-22(18)19;1-16(18(3)21-12-5-4-8-17(21)2)13-14-20-10-6-9-19-11-7-15-23-22(19)20;1-14-7-3-4-11-18(14)15(2)20(22)19(24)13-17-9-5-8-16-10-6-12-23-21(16)17;1-15-7-3-4-11-19(15)16(2)20(22)13-12-18-9-5-8-17-10-6-14-23-21(17)18;1-15-5-8-18(9-6-15)16(2)12-20(23)14-17-7-10-21-19(13-17)4-3-11-22-21;2*1-16-8-3-4-14-20(16)17(2)9-5-10-18-11-6-12-19-13-7-15-22-21(18)19;1-15(18-12-2-3-13-19(18)21)7-4-8-16-9-5-10-17-11-6-14-22-20(16)17/h4-13,16H,3,14-15H2,1-2H3;4-5,7-8,11-17H,3,6,9-10H2,1-2H3;4-12,15-16,18H,13-14H2,1-3H3;3-12,15,20H,13H2,1-2H3;3-11,14,16,20H,12-13H2,1-2H3;3-11,13,16H,12,14H2,1-2H3;2*3-4,6-8,11-15,17H,5,9-10H2,1-2H3;2-3,5-6,9-15H,4,7-8H2,1H3
InChIKeyMDZKUQAIKSHPBM-UHFFFAOYSA-N
XLogP49.23
TPSA185.68 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds49
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002777.22
LogP ≤ 549.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one?
The IUPAC name of 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one (CID 159539298) is 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one.
What is the SMILES notation for 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one?
The canonical SMILES for 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one is CC(CCCc1cccc2cccnc12)c1ccccc1Cl.CCC(CC(=O)Cc1cccc2cccnc12)c1ccccc1OC.CCC(CCCc1cccc2cccnc12)c1ccccc1OC.Cc1ccc(C(C)CC(=O)Cc2ccc3ncccc3c2)cc1.Cc1ccccc1C(C)C(C)CCc1cccc2cccnc12.Cc1ccccc1C(C)C(F)C(=O)Cc1cccc2cccnc12.Cc1ccccc1C(C)C(F)CCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12.Cc1ccccc1C(C)CCCc1cccc2cccnc12.
What is the InChIKey of 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one?
The InChIKey is MDZKUQAIKSHPBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2.C22H25NO.C22H25N.C21H20FNO.C21H22FN.C21H21NO.2C21H23N.C20H20ClN/c1-3-16(20-11-4-5-12-21(20)25-2)14-19(24)15-18-9-6-8-17-10-7-13-23-22(17)18;1-3-17(20-14-4-5-15-21(20)24-2)9-6-10-18-11-7-12-19-13-8-16-23-22(18)19;1-16(18(3)21-12-5-4-8-17(21)2)13-14-20-10-6-9-19-11-7-15-23-22(19)20;1-14-7-3-4-11-18(14)15(2)20(22)19(24)13-17-9-5-8-16-10-6-12-23-21(16)17;1-15-7-3-4-11-19(15)16(2)20(22)13-12-18-9-5-8-17-10-6-14-23-21(17)18;1-15-5-8-18(9-6-15)16(2)12-20(23)14-17-7-10-21-19(13-17)4-3-11-22-21;2*1-16-8-3-4-14-20(16)17(2)9-5-10-18-11-6-12-19-13-7-15-22-21(18)19;1-15(18-12-2-3-13-19(18)21)7-4-8-16-9-5-10-17-11-6-14-22-20(16)17/h4-13,16H,3,14-15H2,1-2H3;4-5,7-8,11-17H,3,6,9-10H2,1-2H3;4-12,15-16,18H,13-14H2,1-3H3;3-12,15,20H,13H2,1-2H3;3-11,14,16,20H,12-13H2,1-2H3;3-11,13,16H,12,14H2,1-2H3;2*3-4,6-8,11-15,17H,5,9-10H2,1-2H3;2-3,5-6,9-15H,4,7-8H2,1H3.
What are the key properties of 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one?
8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one has a molecular weight of 2777.22 g/mol, XLogP of 49.23, 49 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[4-(2-chlorophenyl)pentyl]quinoline;8-[3-fluoro-4-(2-methylphenyl)pentyl]quinoline;3-fluoro-4-(2-methylphenyl)-1-quinolin-8-ylpentan-2-one;8-[4-(2-methoxyphenyl)hexyl]quinoline;4-(2-methoxyphenyl)-1-quinolin-8-ylhexan-2-one;8-[3-methyl-4-(2-methylphenyl)pentyl]quinoline;bis(8-[4-(2-methylphenyl)pentyl]quinoline);4-(4-methylphenyl)-1-quinolin-6-ylpentan-2-one is sourced from PubChem (CID 159539298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).