1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine

C107H120N28O3 — CID 157156597

About 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine

1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine (PubChem CID 157156597) has the molecular formula C107H120N28O3 and a molecular weight of 1846.33 g/mol. Its IUPAC name is 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine.

Molecular Properties

• Compound Name: 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine
• PubChem CID: 157156597
• Molecular Formula: C107H120N28O3
• Molecular Weight: 1846.33 g/mol
• Exact Mass: 1845.01
• IUPAC Name: 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine
• SMILES: CCCCCCn1cnc2c(NC)nc3ccccc3c21.CNc1nc2ccc(C)cc2c2c1ncn2C.CNc1nc2ccccc2c2c1nc(C)n2C.CNc1nc2ccccc2c2c1nc(C)n2Cc1ccccc1.CNc1nc2ccccc2c2c1ncn2CC(O)CO.CNc1nc2ccccc2c2c1ncn2CC1CCCCC1.CNc1nc2ccccc2c2c1ncn2CCO
• InChI: InChI=1S/C19H18N4.C18H22N4.C17H22N4.C14H16N4O2.C13H14N4O.2C13H14N4/c1-13-21-17-18(23(13)12-14-8-4-3-5-9-14)15-10-6-7-11-16(15)22-19(17)20-2;1-19-18-16-17(14-9-5-6-10-15(14)21-18)22(12-20-16)11-13-7-3-2-4-8-13;1-3-4-5-8-11-21-12-19-15-16(21)13-9-6-7-10-14(13)20-17(15)18-2;1-15-14-12-13(10-4-2-3-5-11(10)17-14)18(8-16-12)6-9(20)7-19;1-14-13-11-12(17(6-7-18)8-15-11)9-4-2-3-5-10(9)16-13;1-8-4-5-10-9(6-8)12-11(13(14-2)16-10)15-7-17(12)3;1-8-15-11-12(17(8)3)9-6-4-5-7-10(9)16-13(11)14-2/h3-11H,12H2,1-2H3,(H,20,22);5-6,9-10,12-13H,2-4,7-8,11H2,1H3,(H,19,21);6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,18,20);2-5,8-9,19-20H,6-7H2,1H3,(H,15,17);2-5,8,18H,6-7H2,1H3,(H,14,16);2*4-7H,1-3H3,(H,14,16)
• InChIKey: ALWNBTJPHVLCBF-UHFFFAOYSA-N
• XLogP: 19.94
• TPSA: 359.87 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 31
• Rotatable Bonds: 21
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1846.33
LogP ≤ 5	19.94
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine?

The IUPAC name of 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine (CID 157156597) is 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine.

What is the SMILES notation for 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine?

The canonical SMILES for 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine is CCCCCCn1cnc2c(NC)nc3ccccc3c21.CNc1nc2ccc(C)cc2c2c1ncn2C.CNc1nc2ccccc2c2c1nc(C)n2C.CNc1nc2ccccc2c2c1nc(C)n2Cc1ccccc1.CNc1nc2ccccc2c2c1ncn2CC(O)CO.CNc1nc2ccccc2c2c1ncn2CC1CCCCC1.CNc1nc2ccccc2c2c1ncn2CCO.

What is the InChIKey of 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine?

The InChIKey is ALWNBTJPHVLCBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4.C18H22N4.C17H22N4.C14H16N4O2.C13H14N4O.2C13H14N4/c1-13-21-17-18(23(13)12-14-8-4-3-5-9-14)15-10-6-7-11-16(15)22-19(17)20-2;1-19-18-16-17(14-9-5-6-10-15(14)21-18)22(12-20-16)11-13-7-3-2-4-8-13;1-3-4-5-8-11-21-12-19-15-16(21)13-9-6-7-10-14(13)20-17(15)18-2;1-15-14-12-13(10-4-2-3-5-11(10)17-14)18(8-16-12)6-9(20)7-19;1-14-13-11-12(17(6-7-18)8-15-11)9-4-2-3-5-10(9)16-13;1-8-4-5-10-9(6-8)12-11(13(14-2)16-10)15-7-17(12)3;1-8-15-11-12(17(8)3)9-6-4-5-7-10(9)16-13(11)14-2/h3-11H,12H2,1-2H3,(H,20,22);5-6,9-10,12-13H,2-4,7-8,11H2,1H3,(H,19,21);6-7,9-10,12H,3-5,8,11H2,1-2H3,(H,18,20);2-5,8-9,19-20H,6-7H2,1H3,(H,15,17);2-5,8,18H,6-7H2,1H3,(H,14,16);2*4-7H,1-3H3,(H,14,16).

What are the key properties of 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine?

1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine has a molecular weight of 1846.33 g/mol, XLogP of 19.94, 21 rotatable bonds, 10 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 1-benzyl-N,2-dimethylimidazo[4,5-c]quinolin-4-amine;1-(cyclohexylmethyl)-N-methylimidazo[4,5-c]quinolin-4-amine;1-hexyl-N-methylimidazo[4,5-c]quinolin-4-amine;2-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]ethanol;3-[4-(methylamino)imidazo[4,5-c]quinolin-1-yl]propane-1,2-diol;N,1,2-trimethylimidazo[4,5-c]quinolin-4-amine;N,1,8-trimethylimidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 157156597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).