5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine

C170H195Cl2N11O5S2 — CID 159964197

About 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine

5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine (PubChem CID 159964197) has the molecular formula C170H195Cl2N11O5S2 and a molecular weight of 2607.54 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine.

Molecular Properties

• Compound Name: 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine
• PubChem CID: 159964197
• Molecular Formula: C170H195Cl2N11O5S2
• Molecular Weight: 2607.54 g/mol
• Exact Mass: 2604.42
• IUPAC Name: 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine
• SMILES: CC(C)c1cc2ccccc2s1.CC(C)c1ccc2cc(Cl)ccc2c1.CC(C)c1ccc2ccccc2c1.CC(C)c1ccc2ccccc2c1.CC(C)c1cccc2cnccc12.CC(C)c1cccc2ncccc12.CC(C)c1cccc2nccnc12.CC(C)c1cnc2ccccc2c1.CC(C)c1cnc2ccsc2c1.CCC1=C(C)CN(C(=O)NCCc2ccc(C(C)C)cc2)C1.CCc1noc2ncc(C(C)C)cc12.COc1ccc(Cl)cc1C(=O)NCCc1ccc(C(C)C)cc1.COc1ccc2cc(C(C)C)ccc2c1
• InChI: InChI=1S/C19H22ClNO2.C19H28N2O.C14H16O.C13H13Cl.2C13H14.3C12H13N.C11H14N2O.C11H12N2.C11H12S.C10H11NS/c1-13(2)15-6-4-14(5-7-15)10-11-21-19(22)17-12-16(20)8-9-18(17)23-3;1-5-17-13-21(12-15(17)4)19(22)20-11-10-16-6-8-18(9-7-16)14(2)3;1-10(2)11-4-5-13-9-14(15-3)7-6-12(13)8-11;1-9(2)10-3-4-12-8-13(14)6-5-11(12)7-10;2*1-10(2)12-8-7-11-5-3-4-6-13(11)9-12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-5-3-4-10-8-13-7-6-12(10)11;1-9(2)11-7-10-5-3-4-6-12(10)13-8-11;1-4-10-9-5-8(7(2)3)6-12-11(9)14-13-10;1-8(2)9-4-3-5-10-11(9)13-7-6-12-10;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-7(2)8-5-10-9(11-6-8)3-4-12-10/h4-9,12-13H,10-11H2,1-3H3,(H,21,22);6-9,14H,5,10-13H2,1-4H3,(H,20,22);4-10H,1-3H3;3-9H,1-2H3;2*3-10H,1-2H3;3*3-9H,1-2H3;5-7H,4H2,1-3H3;3-8H,1-2H3;3-8H,1-2H3;3-7H,1-2H3
• InChIKey: ODSGFWSVVRYPKK-UHFFFAOYSA-N
• XLogP: 48.24
• TPSA: 196.16 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 15
• Rotatable Bonds: 24
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2607.54
LogP ≤ 5	48.24
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine?

The IUPAC name of 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine (CID 159964197) is 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine.

What is the SMILES notation for 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine?

The canonical SMILES for 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine is CC(C)c1cc2ccccc2s1.CC(C)c1ccc2cc(Cl)ccc2c1.CC(C)c1ccc2ccccc2c1.CC(C)c1ccc2ccccc2c1.CC(C)c1cccc2cnccc12.CC(C)c1cccc2ncccc12.CC(C)c1cccc2nccnc12.CC(C)c1cnc2ccccc2c1.CC(C)c1cnc2ccsc2c1.CCC1=C(C)CN(C(=O)NCCc2ccc(C(C)C)cc2)C1.CCc1noc2ncc(C(C)C)cc12.COc1ccc(Cl)cc1C(=O)NCCc1ccc(C(C)C)cc1.COc1ccc2cc(C(C)C)ccc2c1.

What is the InChIKey of 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine?

The InChIKey is ODSGFWSVVRYPKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO2.C19H28N2O.C14H16O.C13H13Cl.2C13H14.3C12H13N.C11H14N2O.C11H12N2.C11H12S.C10H11NS/c1-13(2)15-6-4-14(5-7-15)10-11-21-19(22)17-12-16(20)8-9-18(17)23-3;1-5-17-13-21(12-15(17)4)19(22)20-11-10-16-6-8-18(9-7-16)14(2)3;1-10(2)11-4-5-13-9-14(15-3)7-6-12(13)8-11;1-9(2)10-3-4-12-8-13(14)6-5-11(12)7-10;2*1-10(2)12-8-7-11-5-3-4-6-13(11)9-12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;1-9(2)11-5-3-4-10-8-13-7-6-12(10)11;1-9(2)11-7-10-5-3-4-6-12(10)13-8-11;1-4-10-9-5-8(7(2)3)6-12-11(9)14-13-10;1-8(2)9-4-3-5-10-11(9)13-7-6-12-10;1-8(2)11-7-9-5-3-4-6-10(9)12-11;1-7(2)8-5-10-9(11-6-8)3-4-12-10/h4-9,12-13H,10-11H2,1-3H3,(H,21,22);6-9,14H,5,10-13H2,1-4H3,(H,20,22);4-10H,1-3H3;3-9H,1-2H3;2*3-10H,1-2H3;3*3-9H,1-2H3;5-7H,4H2,1-3H3;3-8H,1-2H3;3-8H,1-2H3;3-7H,1-2H3.

What are the key properties of 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine?

5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine has a molecular weight of 2607.54 g/mol, XLogP of 48.24, 24 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 5-chloro-2-methoxy-N-[2-(4-propan-2-ylphenyl)ethyl]benzamide;2-chloro-6-propan-2-ylnaphthalene;3-ethyl-4-methyl-N-[2-(4-propan-2-ylphenyl)ethyl]-2,5-dihydropyrrole-1-carboxamide;3-ethyl-5-propan-2-yl-[1,2]oxazolo[5,4-b]pyridine;2-methoxy-6-propan-2-ylnaphthalene;2-propan-2-yl-1-benzothiophene;5-propan-2-ylisoquinoline;bis(2-propan-2-ylnaphthalene);3-propan-2-ylquinoline;5-propan-2-ylquinoline;5-propan-2-ylquinoxaline;6-propan-2-ylthieno[3,2-b]pyridine is sourced from PubChem (CID 159964197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).