8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline

C211H268Cl4F5N13O — CID 159896285

About 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline

8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline (PubChem CID 159896285) has the molecular formula C211H268Cl4F5N13O and a molecular weight of 3239.36 g/mol. Its IUPAC name is 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline.

Molecular Properties

• Compound Name: 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline
• PubChem CID: 159896285
• Molecular Formula: C211H268Cl4F5N13O
• Molecular Weight: 3239.36 g/mol
• Exact Mass: 3235.00
• IUPAC Name: 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline
• SMILES: CC(C)c1ccc2c(c1)C(F)(F)CCC2.CC(C)c1ccc2c(c1)CCCC2(F)F.CC(C)c1ccc2c(c1Cl)N(C)CCC2.CC(C)c1ccc2c(c1Cl)NCCC2.CC(C)c1ccc2c3c(ccnc13)CCO2.CC(C)c1ccc2ccccc2c1Cl.CC(C)c1cccc2cccnc12.CCN1CCCc2ccc(C(C)C)c(C)c21.CCN1CCCc2ccc(C(C)C)c(Cl)c21.Cc1c(C(C)C)ccc2c1N(C)CCC2.Cc1c(C(C)C)ccc2c1NCCC2.Cc1c(C(C)C)ccc2c1NCCC2.Cc1cc(F)c(C(C)C)c2ncccc12.Cc1ccc(C(C)C)c2ncccc12.Cc1ccc(C(C)C)c2ncccc12.Cc1ccnc2c(C(C)C)cccc12
• InChI: InChI=1S/C15H23N.C14H20ClN.C14H15NO.C14H21N.C13H18ClN.C13H13Cl.2C13H16F2.C13H14FN.2C13H19N.3C13H15N.C12H16ClN.C12H13N/c1-5-16-10-6-7-13-8-9-14(11(2)3)12(4)15(13)16;1-4-16-9-5-6-11-7-8-12(10(2)3)13(15)14(11)16;1-9(2)11-3-4-12-13-10(6-8-16-12)5-7-15-14(11)13;1-10(2)13-8-7-12-6-5-9-15(4)14(12)11(13)3;1-9(2)11-7-6-10-5-4-8-15(3)13(10)12(11)14;1-9(2)11-8-7-10-5-3-4-6-12(10)13(11)14;1-9(2)10-5-6-12-11(8-10)4-3-7-13(12,14)15;1-9(2)11-6-5-10-4-3-7-13(14,15)12(10)8-11;1-8(2)12-11(14)7-9(3)10-5-4-6-15-13(10)12;2*1-9(2)12-7-6-11-5-4-8-14-13(11)10(12)3;2*1-9(2)11-7-6-10(3)12-5-4-8-14-13(11)12;1-9(2)11-5-4-6-12-10(3)7-8-14-13(11)12;1-8(2)10-6-5-9-4-3-7-14-12(9)11(10)13;1-9(2)11-7-3-5-10-6-4-8-13-12(10)11/h8-9,11H,5-7,10H2,1-4H3;7-8,10H,4-6,9H2,1-3H3;3-5,7,9H,6,8H2,1-2H3;7-8,10H,5-6,9H2,1-4H3;6-7,9H,4-5,8H2,1-3H3;3-9H,1-2H3;2*5-6,8-9H,3-4,7H2,1-2H3;4-8H,1-3H3;2*6-7,9,14H,4-5,8H2,1-3H3;3*4-9H,1-3H3;5-6,8,14H,3-4,7H2,1-2H3;3-9H,1-2H3
• InChIKey: NVJPIOTUOQBNBG-UHFFFAOYSA-N
• XLogP: 60.80
• TPSA: 135.62 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 14
• Rotatable Bonds: 18
• Heavy Atoms: 234
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3239.36
LogP ≤ 5	60.80
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	14

Frequently Asked Questions

What is the IUPAC name of 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline?

The IUPAC name of 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline (CID 159896285) is 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline.

What is the SMILES notation for 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline?

The canonical SMILES for 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline is CC(C)c1ccc2c(c1)C(F)(F)CCC2.CC(C)c1ccc2c(c1)CCCC2(F)F.CC(C)c1ccc2c(c1Cl)N(C)CCC2.CC(C)c1ccc2c(c1Cl)NCCC2.CC(C)c1ccc2c3c(ccnc13)CCO2.CC(C)c1ccc2ccccc2c1Cl.CC(C)c1cccc2cccnc12.CCN1CCCc2ccc(C(C)C)c(C)c21.CCN1CCCc2ccc(C(C)C)c(Cl)c21.Cc1c(C(C)C)ccc2c1N(C)CCC2.Cc1c(C(C)C)ccc2c1NCCC2.Cc1c(C(C)C)ccc2c1NCCC2.Cc1cc(F)c(C(C)C)c2ncccc12.Cc1ccc(C(C)C)c2ncccc12.Cc1ccc(C(C)C)c2ncccc12.Cc1ccnc2c(C(C)C)cccc12.

What is the InChIKey of 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline?

The InChIKey is NVJPIOTUOQBNBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N.C14H20ClN.C14H15NO.C14H21N.C13H18ClN.C13H13Cl.2C13H16F2.C13H14FN.2C13H19N.3C13H15N.C12H16ClN.C12H13N/c1-5-16-10-6-7-13-8-9-14(11(2)3)12(4)15(13)16;1-4-16-9-5-6-11-7-8-12(10(2)3)13(15)14(11)16;1-9(2)11-3-4-12-13-10(6-8-16-12)5-7-15-14(11)13;1-10(2)13-8-7-12-6-5-9-15(4)14(12)11(13)3;1-9(2)11-7-6-10-5-4-8-15(3)13(10)12(11)14;1-9(2)11-8-7-10-5-3-4-6-12(10)13(11)14;1-9(2)10-5-6-12-11(8-10)4-3-7-13(12,14)15;1-9(2)11-6-5-10-4-3-7-13(14,15)12(10)8-11;1-8(2)12-11(14)7-9(3)10-5-4-6-15-13(10)12;2*1-9(2)12-7-6-11-5-4-8-14-13(11)10(12)3;2*1-9(2)11-7-6-10(3)12-5-4-8-14-13(11)12;1-9(2)11-5-4-6-12-10(3)7-8-14-13(11)12;1-8(2)10-6-5-9-4-3-7-14-12(9)11(10)13;1-9(2)11-7-3-5-10-6-4-8-13-12(10)11/h8-9,11H,5-7,10H2,1-4H3;7-8,10H,4-6,9H2,1-3H3;3-5,7,9H,6,8H2,1-2H3;7-8,10H,5-6,9H2,1-4H3;6-7,9H,4-5,8H2,1-3H3;3-9H,1-2H3;2*5-6,8-9H,3-4,7H2,1-2H3;4-8H,1-3H3;2*6-7,9,14H,4-5,8H2,1-3H3;3*4-9H,1-3H3;5-6,8,14H,3-4,7H2,1-2H3;3-9H,1-2H3.

What are the key properties of 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline?

8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline has a molecular weight of 3239.36 g/mol, XLogP of 60.80, 18 rotatable bonds, 3 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 8-chloro-1-ethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;8-chloro-1-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-chloro-2-propan-2-ylnaphthalene;8-chloro-7-propan-2-yl-1,2,3,4-tetrahydroquinoline;4,4-difluoro-6-propan-2-yl-2,3-dihydro-1H-naphthalene;4,4-difluoro-7-propan-2-yl-2,3-dihydro-1H-naphthalene;1,8-dimethyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;1-ethyl-8-methyl-7-propan-2-yl-3,4-dihydro-2H-quinoline;7-fluoro-5-methyl-8-propan-2-ylquinoline;4-methyl-8-propan-2-ylquinoline;bis(5-methyl-8-propan-2-ylquinoline);bis(8-methyl-7-propan-2-yl-1,2,3,4-tetrahydroquinoline);10-propan-2-yl-2-oxa-8-azatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene;8-propan-2-ylquinoline is sourced from PubChem (CID 159896285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).