5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol

C128H125ClN14O10S — CID 159417503

About 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol

5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol (PubChem CID 159417503) has the molecular formula C128H125ClN14O10S and a molecular weight of 2087.02 g/mol. Its IUPAC name is 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol.

Molecular Properties

• Compound Name: 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
• PubChem CID: 159417503
• Molecular Formula: C128H125ClN14O10S
• Molecular Weight: 2087.02 g/mol
• Exact Mass: 2084.91
• IUPAC Name: 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol
• SMILES: C.C.COc1ccc(C(c2ccc3cccnc3c2O)N2CCOCC2)cc1.Cc1ccc(C(Nc2cccnc2)c2ccc3cccnc3c2O)cc1.Cc1ccc(C(c2ccc3cccnc3c2O)N2CCOCC2)cc1.Cc1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1.Oc1c(C(Nc2ccccn2)c2ccccc2)ccc2cccnc12.Oc1c(C(c2cccs2)N2CCOCC2)cc(Cl)c2cccnc12
• InChI: InChI=1S/C23H20N2O.C22H19N3O.C21H17N3O.C21H22N2O3.C21H22N2O2.C18H17ClN2O2S.2CH4/c1-16-9-12-19(13-10-16)25-21(17-6-3-2-4-7-17)20-14-11-18-8-5-15-24-22(18)23(20)26;1-15-6-8-17(9-7-15)20(25-18-5-3-12-23-14-18)19-11-10-16-4-2-13-24-21(16)22(19)26;25-21-17(12-11-16-9-6-14-23-20(16)21)19(15-7-2-1-3-8-15)24-18-10-4-5-13-22-18;1-25-17-7-4-16(5-8-17)20(23-11-13-26-14-12-23)18-9-6-15-3-2-10-22-19(15)21(18)24;1-15-4-6-17(7-5-15)20(23-11-13-25-14-12-23)18-9-8-16-3-2-10-22-19(16)21(18)24;19-14-11-13(18(22)16-12(14)3-1-5-20-16)17(15-4-2-10-24-15)21-6-8-23-9-7-21;;/h2-15,21,25-26H,1H3;2-14,20,25-26H,1H3;1-14,19,25H,(H,22,24);2-10,20,24H,11-14H2,1H3;2-10,20,24H,11-14H2,1H3;1-5,10-11,17,22H,6-9H2;2*1H4
• InChIKey: LPIOEAMUASHTMF-UHFFFAOYSA-N
• XLogP: 27.22
• TPSA: 307.23 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 25
• Rotatable Bonds: 22
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2087.02
LogP ≤ 5	27.22
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?

The IUPAC name of 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol (CID 159417503) is 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol.

What is the SMILES notation for 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?

The canonical SMILES for 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol is C.C.COc1ccc(C(c2ccc3cccnc3c2O)N2CCOCC2)cc1.Cc1ccc(C(Nc2cccnc2)c2ccc3cccnc3c2O)cc1.Cc1ccc(C(c2ccc3cccnc3c2O)N2CCOCC2)cc1.Cc1ccc(NC(c2ccccc2)c2ccc3cccnc3c2O)cc1.Oc1c(C(Nc2ccccn2)c2ccccc2)ccc2cccnc12.Oc1c(C(c2cccs2)N2CCOCC2)cc(Cl)c2cccnc12.

What is the InChIKey of 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?

The InChIKey is LPIOEAMUASHTMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O.C22H19N3O.C21H17N3O.C21H22N2O3.C21H22N2O2.C18H17ClN2O2S.2CH4/c1-16-9-12-19(13-10-16)25-21(17-6-3-2-4-7-17)20-14-11-18-8-5-15-24-22(18)23(20)26;1-15-6-8-17(9-7-15)20(25-18-5-3-12-23-14-18)19-11-10-16-4-2-13-24-21(16)22(19)26;25-21-17(12-11-16-9-6-14-23-20(16)21)19(15-7-2-1-3-8-15)24-18-10-4-5-13-22-18;1-25-17-7-4-16(5-8-17)20(23-11-13-26-14-12-23)18-9-6-15-3-2-10-22-19(15)21(18)24;1-15-4-6-17(7-5-15)20(23-11-13-25-14-12-23)18-9-8-16-3-2-10-22-19(16)21(18)24;19-14-11-13(18(22)16-12(14)3-1-5-20-16)17(15-4-2-10-24-15)21-6-8-23-9-7-21;;/h2-15,21,25-26H,1H3;2-14,20,25-26H,1H3;1-14,19,25H,(H,22,24);2-10,20,24H,11-14H2,1H3;2-10,20,24H,11-14H2,1H3;1-5,10-11,17,22H,6-9H2;2*1H4.

What are the key properties of 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol?

5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol has a molecular weight of 2087.02 g/mol, XLogP of 27.22, 22 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-7-[morpholin-4-yl(thiophen-2-yl)methyl]quinolin-8-ol;methane;7-[(4-methoxyphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylanilino)-phenylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-morpholin-4-ylmethyl]quinolin-8-ol;7-[(4-methylphenyl)-(pyridin-3-ylamino)methyl]quinolin-8-ol;7-[phenyl-(pyridin-2-ylamino)methyl]quinolin-8-ol is sourced from PubChem (CID 159417503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).