4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine

C66H89Cl3N6O10 — CID 157293607

About 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine

4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine (PubChem CID 157293607) has the molecular formula C66H89Cl3N6O10 and a molecular weight of 1232.83 g/mol. Its IUPAC name is 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine.

Molecular Properties

• Compound Name: 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine
• PubChem CID: 157293607
• Molecular Formula: C66H89Cl3N6O10
• Molecular Weight: 1232.83 g/mol
• Exact Mass: 1230.57
• IUPAC Name: 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine
• SMILES: CC(C)=Cc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.CC(C)Oc1cc(C2CCCCC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CCOc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1
• InChI: InChI=1S/C24H33ClN2O3.C22H29ClN2O3.C20H27ClN2O4/c1-17(2)30-22-16-20(18-6-4-3-5-7-18)26-24-19(22)8-9-21(23(24)25)29-15-12-27-10-13-28-14-11-27;1-15(2)13-17-14-20(28-16(3)4)18-5-6-19(21(23)22(18)24-17)27-12-9-25-7-10-26-11-8-25;1-4-25-18-13-17(27-14(2)3)15-5-6-16(19(21)20(15)22-18)26-12-9-23-7-10-24-11-8-23/h8-9,16-18H,3-7,10-15H2,1-2H3;5-6,13-14,16H,7-12H2,1-4H3;5-6,13-14H,4,7-12H2,1-3H3
• InChIKey: BBBVOTSMBPQTDK-UHFFFAOYSA-N
• XLogP: 14.03
• TPSA: 140.69 Ų
• H-Bond Acceptors: 16
• Rotatable Bonds: 22
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1232.83
LogP ≤ 5	14.03
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	16

Frequently Asked Questions

What is the IUPAC name of 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine?

The IUPAC name of 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine (CID 157293607) is 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine.

What is the SMILES notation for 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine?

The canonical SMILES for 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine is CC(C)=Cc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.CC(C)Oc1cc(C2CCCCC2)nc2c(Cl)c(OCCN3CCOCC3)ccc12.CCOc1cc(OC(C)C)c2ccc(OCCN3CCOCC3)c(Cl)c2n1.

What is the InChIKey of 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine?

The InChIKey is BBBVOTSMBPQTDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33ClN2O3.C22H29ClN2O3.C20H27ClN2O4/c1-17(2)30-22-16-20(18-6-4-3-5-7-18)26-24-19(22)8-9-21(23(24)25)29-15-12-27-10-13-28-14-11-27;1-15(2)13-17-14-20(28-16(3)4)18-5-6-19(21(23)22(18)24-17)27-12-9-25-7-10-26-11-8-25;1-4-25-18-13-17(27-14(2)3)15-5-6-16(19(21)20(15)22-18)26-12-9-23-7-10-24-11-8-23/h8-9,16-18H,3-7,10-15H2,1-2H3;5-6,13-14,16H,7-12H2,1-4H3;5-6,13-14H,4,7-12H2,1-3H3.

What are the key properties of 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine?

4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine has a molecular weight of 1232.83 g/mol, XLogP of 14.03, 22 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(8-chloro-2-cyclohexyl-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-(8-chloro-2-ethoxy-4-propan-2-yloxyquinolin-7-yl)oxyethyl]morpholine;4-[2-[8-chloro-2-(2-methylprop-1-enyl)-4-propan-2-yloxyquinolin-7-yl]oxyethyl]morpholine is sourced from PubChem (CID 157293607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).