1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine

C147H186N18O27 — CID 160541083

About 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine

1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine (PubChem CID 160541083) has the molecular formula C147H186N18O27 and a molecular weight of 2637.20 g/mol. Its IUPAC name is 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine.

Molecular Properties

• Compound Name: 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine
• PubChem CID: 160541083
• Molecular Formula: C147H186N18O27
• Molecular Weight: 2637.20 g/mol
• Exact Mass: 2635.37
• IUPAC Name: 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine
• SMILES: C.C.C.C.CCCC(=O)N1CCC(COc2cccc3nc(C)cc(N)c23)CC1.Cc1cc(N)c2c(OC3CCCCC3)cccc2n1.Cc1cc(N)c2c(OC3CCCCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)(C)NC(=O)C3CCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)(C)NC(=O)C3CCCCC3)cccc2n1.Cc1cc(N)c2c(OCC3CCN(C(=O)c4cccc(O)c4)CC3)cccc2n1.Cc1cc(N)c2c(OCCCOc3ccccc3)cccc2n1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O
• InChI: InChI=1S/C23H25N3O3.C21H29N3O2.2C20H27N3O2.C19H20N2O2.C17H22N2O.C16H20N2O.7CO2.4CH4/c1-15-12-19(24)22-20(25-15)6-3-7-21(22)29-14-16-8-10-26(11-9-16)23(28)17-4-2-5-18(27)13-17;1-14-12-16(22)19-17(23-14)10-7-11-18(19)26-13-21(2,3)24-20(25)15-8-5-4-6-9-15;1-13-11-15(21)18-16(22-13)9-6-10-17(18)25-12-20(2,3)23-19(24)14-7-4-5-8-14;1-3-5-19(24)23-10-8-15(9-11-23)13-25-18-7-4-6-17-20(18)16(21)12-14(2)22-17;1-14-13-16(20)19-17(21-14)9-5-10-18(19)23-12-6-11-22-15-7-3-2-4-8-15;1-12-11-14(18)17-15(19-12)9-6-10-16(17)20-13-7-4-2-3-5-8-13;1-11-10-13(17)16-14(18-11)8-5-9-15(16)19-12-6-3-2-4-7-12;7*2-1-3;;;;/h2-7,12-13,16,27H,8-11,14H2,1H3,(H2,24,25);7,10-12,15H,4-6,8-9,13H2,1-3H3,(H2,22,23)(H,24,25);6,9-11,14H,4-5,7-8,12H2,1-3H3,(H2,21,22)(H,23,24);4,6-7,12,15H,3,5,8-11,13H2,1-2H3,(H2,21,22);2-5,7-10,13H,6,11-12H2,1H3,(H2,20,21);6,9-11,13H,2-5,7-8H2,1H3,(H2,18,19);5,8-10,12H,2-4,6-7H2,1H3,(H2,17,18);;;;;;;;4*1H4
• InChIKey: QWUHRBPHECWZBZ-UHFFFAOYSA-N
• XLogP: 25.37
• TPSA: 704.24 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 41
• Rotatable Bonds: 29
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2637.20
LogP ≤ 5	25.37
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine?

The IUPAC name of 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine (CID 160541083) is 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine.

What is the SMILES notation for 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine?

The canonical SMILES for 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine is C.C.C.C.CCCC(=O)N1CCC(COc2cccc3nc(C)cc(N)c23)CC1.Cc1cc(N)c2c(OC3CCCCC3)cccc2n1.Cc1cc(N)c2c(OC3CCCCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)(C)NC(=O)C3CCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)(C)NC(=O)C3CCCCC3)cccc2n1.Cc1cc(N)c2c(OCC3CCN(C(=O)c4cccc(O)c4)CC3)cccc2n1.Cc1cc(N)c2c(OCCCOc3ccccc3)cccc2n1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.

What is the InChIKey of 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine?

The InChIKey is QWUHRBPHECWZBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3.C21H29N3O2.2C20H27N3O2.C19H20N2O2.C17H22N2O.C16H20N2O.7CO2.4CH4/c1-15-12-19(24)22-20(25-15)6-3-7-21(22)29-14-16-8-10-26(11-9-16)23(28)17-4-2-5-18(27)13-17;1-14-12-16(22)19-17(23-14)10-7-11-18(19)26-13-21(2,3)24-20(25)15-8-5-4-6-9-15;1-13-11-15(21)18-16(22-13)9-6-10-17(18)25-12-20(2,3)23-19(24)14-7-4-5-8-14;1-3-5-19(24)23-10-8-15(9-11-23)13-25-18-7-4-6-17-20(18)16(21)12-14(2)22-17;1-14-13-16(20)19-17(21-14)9-5-10-18(19)23-12-6-11-22-15-7-3-2-4-8-15;1-12-11-14(18)17-15(19-12)9-6-10-16(17)20-13-7-4-2-3-5-8-13;1-11-10-13(17)16-14(18-11)8-5-9-15(16)19-12-6-3-2-4-7-12;7*2-1-3;;;;/h2-7,12-13,16,27H,8-11,14H2,1H3,(H2,24,25);7,10-12,15H,4-6,8-9,13H2,1-3H3,(H2,22,23)(H,24,25);6,9-11,14H,4-5,7-8,12H2,1-3H3,(H2,21,22)(H,23,24);4,6-7,12,15H,3,5,8-11,13H2,1-2H3,(H2,21,22);2-5,7-10,13H,6,11-12H2,1H3,(H2,20,21);6,9-11,13H,2-5,7-8H2,1H3,(H2,18,19);5,8-10,12H,2-4,6-7H2,1H3,(H2,17,18);;;;;;;;4*1H4.

What are the key properties of 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine?

1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine has a molecular weight of 2637.20 g/mol, XLogP of 25.37, 29 rotatable bonds, 10 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]butan-1-one;[4-[(4-amino-2-methylquinolin-5-yl)oxymethyl]piperidin-1-yl]-(3-hydroxyphenyl)methanone;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]cyclopentanecarboxamide;heptakis(carbon dioxide);5-cycloheptyloxy-2-methylquinolin-4-amine;5-cyclohexyloxy-2-methylquinolin-4-amine;methane;2-methyl-5-(3-phenoxypropoxy)quinolin-4-amine is sourced from PubChem (CID 160541083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).