N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)

C135H146N18O28 — CID 157195845

IUPACN-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)
SMILESCOc1cc(C)cc(C(=O)NC(C)(C)COc2cccc3nc(C)cc(N)c23)c1.Cc1cc(N)c2c(OCC(C)NC(=O)C3CCCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccc4c(c3)OCCO4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3cccc4c3OCCC4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccccc3)cccc2n1.Cc1cccc(C(=O)NC(C)COc2cccc3nc(C)cc(N)c23)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O
InChIInChI=1S/C23H25N3O3.C23H27N3O3.C22H23N3O4.C21H23N3O2.C20H27N3O2.C20H21N3O2.6CO2/c1-14-12-18(24)21-19(25-14)9-4-10-20(21)29-13-15(2)26-23(27)17-8-3-6-16-7-5-11-28-22(16)17;1-14-9-16(12-17(10-14)28-5)22(27)26-23(3,4)13-29-20-8-6-7-19-21(20)18(24)11-15(2)25-19;1-13-10-16(23)21-17(24-13)4-3-5-19(21)29-12-14(2)25-22(26)15-6-7-18-20(11-15)28-9-8-27-18;1-13-6-4-7-16(10-13)21(25)24-15(3)12-26-19-9-5-8-18-20(19)17(22)11-14(2)23-18;2*1-13-11-16(21)19-17(22-13)9-6-10-18(19)25-12-14(2)23-20(24)15-7-4-3-5-8-15;6*2-1-3/h3-4,6,8-10,12,15H,5,7,11,13H2,1-2H3,(H2,24,25)(H,26,27);6-12H,13H2,1-5H3,(H2,24,25)(H,26,27);3-7,10-11,14H,8-9,12H2,1-2H3,(H2,23,24)(H,25,26);4-11,15H,12H2,1-3H3,(H2,22,23)(H,24,25);6,9-11,14-15H,3-5,7-8,12H2,1-2H3,(H2,21,22)(H,23,24);3-11,14H,12H2,1-2H3,(H2,21,22)(H,23,24);;;;;;
InChIKeyAQFXFDQPVYCHGT-UHFFFAOYSA-N
MW2468.75 g/mol
LogP17.81
Rot. Bonds31

About N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)

N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) (PubChem CID 157195845) has the molecular formula C135H146N18O28 and a molecular weight of 2468.75 g/mol. Its IUPAC name is N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide).

Molecular Properties

Compound NameN-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)
PubChem CID157195845
Molecular FormulaC135H146N18O28
Molecular Weight2468.75 g/mol
Exact Mass2467.06
IUPAC NameN-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)
SMILESCOc1cc(C)cc(C(=O)NC(C)(C)COc2cccc3nc(C)cc(N)c23)c1.Cc1cc(N)c2c(OCC(C)NC(=O)C3CCCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccc4c(c3)OCCO4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3cccc4c3OCCC4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccccc3)cccc2n1.Cc1cccc(C(=O)NC(C)COc2cccc3nc(C)cc(N)c23)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O
InChIInChI=1S/C23H25N3O3.C23H27N3O3.C22H23N3O4.C21H23N3O2.C20H27N3O2.C20H21N3O2.6CO2/c1-14-12-18(24)21-19(25-14)9-4-10-20(21)29-13-15(2)26-23(27)17-8-3-6-16-7-5-11-28-22(16)17;1-14-9-16(12-17(10-14)28-5)22(27)26-23(3,4)13-29-20-8-6-7-19-21(20)18(24)11-15(2)25-19;1-13-10-16(23)21-17(24-13)4-3-5-19(21)29-12-14(2)25-22(26)15-6-7-18-20(11-15)28-9-8-27-18;1-13-6-4-7-16(10-13)21(25)24-15(3)12-26-19-9-5-8-18-20(19)17(22)11-14(2)23-18;2*1-13-11-16(21)19-17(22-13)9-6-10-18(19)25-12-14(2)23-20(24)15-7-4-3-5-8-15;6*2-1-3/h3-4,6,8-10,12,15H,5,7,11,13H2,1-2H3,(H2,24,25)(H,26,27);6-12H,13H2,1-5H3,(H2,24,25)(H,26,27);3-7,10-11,14H,8-9,12H2,1-2H3,(H2,23,24)(H,25,26);4-11,15H,12H2,1-3H3,(H2,22,23)(H,24,25);6,9-11,14-15H,3-5,7-8,12H2,1-2H3,(H2,21,22)(H,23,24);3-11,14H,12H2,1-2H3,(H2,21,22)(H,23,24);;;;;;
InChIKeyAQFXFDQPVYCHGT-UHFFFAOYSA-N
XLogP17.81
TPSA705.20 Ų
H-Bond Donors12
H-Bond Acceptors40
Rotatable Bonds31
Heavy Atoms181
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002468.75
LogP ≤ 517.81
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1040

Analyze N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)?
The IUPAC name of N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) (CID 157195845) is N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide).
What is the SMILES notation for N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)?
The canonical SMILES for N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) is COc1cc(C)cc(C(=O)NC(C)(C)COc2cccc3nc(C)cc(N)c23)c1.Cc1cc(N)c2c(OCC(C)NC(=O)C3CCCCC3)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccc4c(c3)OCCO4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3cccc4c3OCCC4)cccc2n1.Cc1cc(N)c2c(OCC(C)NC(=O)c3ccccc3)cccc2n1.Cc1cccc(C(=O)NC(C)COc2cccc3nc(C)cc(N)c23)c1.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.O=C=O.
What is the InChIKey of N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)?
The InChIKey is AQFXFDQPVYCHGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3.C23H27N3O3.C22H23N3O4.C21H23N3O2.C20H27N3O2.C20H21N3O2.6CO2/c1-14-12-18(24)21-19(25-14)9-4-10-20(21)29-13-15(2)26-23(27)17-8-3-6-16-7-5-11-28-22(16)17;1-14-9-16(12-17(10-14)28-5)22(27)26-23(3,4)13-29-20-8-6-7-19-21(20)18(24)11-15(2)25-19;1-13-10-16(23)21-17(24-13)4-3-5-19(21)29-12-14(2)25-22(26)15-6-7-18-20(11-15)28-9-8-27-18;1-13-6-4-7-16(10-13)21(25)24-15(3)12-26-19-9-5-8-18-20(19)17(22)11-14(2)23-18;2*1-13-11-16(21)19-17(22-13)9-6-10-18(19)25-12-14(2)23-20(24)15-7-4-3-5-8-15;6*2-1-3/h3-4,6,8-10,12,15H,5,7,11,13H2,1-2H3,(H2,24,25)(H,26,27);6-12H,13H2,1-5H3,(H2,24,25)(H,26,27);3-7,10-11,14H,8-9,12H2,1-2H3,(H2,23,24)(H,25,26);4-11,15H,12H2,1-3H3,(H2,22,23)(H,24,25);6,9-11,14-15H,3-5,7-8,12H2,1-2H3,(H2,21,22)(H,23,24);3-11,14H,12H2,1-2H3,(H2,21,22)(H,23,24);;;;;;.
What are the key properties of N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide)?
N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) has a molecular weight of 2468.75 g/mol, XLogP of 17.81, 31 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-amino-2-methylquinolin-5-yl)oxy-2-methylpropan-2-yl]-3-methoxy-5-methylbenzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]benzamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]cyclohexanecarboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3,4-dihydro-2H-chromene-8-carboxamide;N-[1-(4-amino-2-methylquinolin-5-yl)oxypropan-2-yl]-3-methylbenzamide;hexakis(carbon dioxide) is sourced from PubChem (CID 157195845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).