1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate

C172H192ClF2N17O22 — CID 158295584

About 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate

1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate (PubChem CID 158295584) has the molecular formula C172H192ClF2N17O22 and a molecular weight of 2922.97 g/mol. Its IUPAC name is 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate.

Molecular Properties

• Compound Name: 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate
• PubChem CID: 158295584
• Molecular Formula: C172H192ClF2N17O22
• Molecular Weight: 2922.97 g/mol
• Exact Mass: 2920.41
• IUPAC Name: 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate
• SMILES: CC(C)OC(=O)Nc1ccc(-c2c(-c3ccc(C#N)cc3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nn[nH]n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(F)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2cc3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)C1CC1.CCOc1ccc2c(Cl)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(F)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1
• InChI: InChI=1S/C34H35N3O4.C29H33FN2O4.C29H34N2O4.C28H32N6O4.C26H29ClN2O3.C26H29FN2O3/c1-22(2)40-34(38)36-26-12-10-25(11-13-26)33-32(24-8-6-23(21-35)7-9-24)30-15-14-29(41-28-16-18-39-19-17-28)20-31(30)37(33)27-4-3-5-27;1-18(19-5-6-19)35-29(33)31-21-9-7-20(8-10-21)28-27(30)25-12-11-24(36-23-13-15-34-16-14-23)17-26(25)32(28)22-3-2-4-22;1-19(20-5-6-20)34-29(32)30-23-10-7-21(8-11-23)27-17-22-9-12-26(35-25-13-15-33-16-14-25)18-28(22)31(27)24-3-2-4-24;1-17(2)37-28(35)29-19-8-6-18(7-9-19)26-25(27-30-32-33-31-27)23-11-10-22(38-21-12-14-36-15-13-21)16-24(23)34(26)20-4-3-5-20;2*1-3-31-21-13-14-22-23(15-21)29(20-5-4-6-20)25(24(22)27)18-9-11-19(12-10-18)28-26(30)32-16(2)17-7-8-17/h6-15,20,22,27-28H,3-5,16-19H2,1-2H3,(H,36,38);7-12,17-19,22-23H,2-6,13-16H2,1H3,(H,31,33);7-12,17-20,24-25H,2-6,13-16H2,1H3,(H,30,32);6-11,16-17,20-21H,3-5,12-15H2,1-2H3,(H,29,35)(H,30,31,32,33);2*9-17,20H,3-8H2,1-2H3,(H,28,30)
• InChIKey: GLWHIEJDAKRJFY-UHFFFAOYSA-N
• XLogP: 42.18
• TPSA: 430.11 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 32
• Rotatable Bonds: 42
• Heavy Atoms: 214
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2922.97
LogP ≤ 5	42.18
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate?

The IUPAC name of 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate (CID 158295584) is 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate.

What is the SMILES notation for 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate?

The canonical SMILES for 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2c(-c3ccc(C#N)cc3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3nn[nH]n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(F)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)C1CC1.CC(OC(=O)Nc1ccc(-c2cc3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)C1CC1.CCOc1ccc2c(Cl)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.CCOc1ccc2c(F)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.

What is the InChIKey of 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate?

The InChIKey is GLWHIEJDAKRJFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H35N3O4.C29H33FN2O4.C29H34N2O4.C28H32N6O4.C26H29ClN2O3.C26H29FN2O3/c1-22(2)40-34(38)36-26-12-10-25(11-13-26)33-32(24-8-6-23(21-35)7-9-24)30-15-14-29(41-28-16-18-39-19-17-28)20-31(30)37(33)27-4-3-5-27;1-18(19-5-6-19)35-29(33)31-21-9-7-20(8-10-21)28-27(30)25-12-11-24(36-23-13-15-34-16-14-23)17-26(25)32(28)22-3-2-4-22;1-19(20-5-6-20)34-29(32)30-23-10-7-21(8-11-23)27-17-22-9-12-26(35-25-13-15-33-16-14-25)18-28(22)31(27)24-3-2-4-24;1-17(2)37-28(35)29-19-8-6-18(7-9-19)26-25(27-30-32-33-31-27)23-11-10-22(38-21-12-14-36-15-13-21)16-24(23)34(26)20-4-3-5-20;2*1-3-31-21-13-14-22-23(15-21)29(20-5-4-6-20)25(24(22)27)18-9-11-19(12-10-18)28-26(30)32-16(2)17-7-8-17/h6-15,20,22,27-28H,3-5,16-19H2,1-2H3,(H,36,38);7-12,17-19,22-23H,2-6,13-16H2,1H3,(H,31,33);7-12,17-20,24-25H,2-6,13-16H2,1H3,(H,30,32);6-11,16-17,20-21H,3-5,12-15H2,1-2H3,(H,29,35)(H,30,31,32,33);2*9-17,20H,3-8H2,1-2H3,(H,28,30).

What are the key properties of 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate?

1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate has a molecular weight of 2922.97 g/mol, XLogP of 42.18, 42 rotatable bonds, 7 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropylethyl N-[4-(3-chloro-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-(1-cyclobutyl-6-ethoxy-3-fluoroindol-2-yl)phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-fluoro-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-(4-cyanophenyl)-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(2H-tetrazol-5-yl)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 158295584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).