1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate

C131H145F3N12O16S3 — CID 158781149

About 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate

1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate (PubChem CID 158781149) has the molecular formula C131H145F3N12O16S3 and a molecular weight of 2296.86 g/mol. Its IUPAC name is 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate.

Molecular Properties

• Compound Name: 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
• PubChem CID: 158781149
• Molecular Formula: C131H145F3N12O16S3
• Molecular Weight: 2296.86 g/mol
• Exact Mass: 2295.00
• IUPAC Name: 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate
• SMILES: CCOc1ccc2c(-c3nc(C(F)(F)F)cs3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.Cc1csc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)n1.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)oc1C.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)sc1C
• InChI: InChI=1S/C34H39N3O5.C34H39N3O4S.C33H37N3O4S.C30H30F3N3O3S/c1-20-21(2)40-33(35-20)31-29-14-13-28(42-27-15-17-39-18-16-27)19-30(29)37(26-5-4-6-26)32(31)24-9-11-25(12-10-24)36-34(38)41-22(3)23-7-8-23;1-20-22(3)42-33(35-20)31-29-14-13-28(41-27-15-17-39-18-16-27)19-30(29)37(26-5-4-6-26)32(31)24-9-11-25(12-10-24)36-34(38)40-21(2)23-7-8-23;1-20-19-41-32(34-20)30-28-13-12-27(40-26-14-16-38-17-15-26)18-29(28)36(25-4-3-5-25)31(30)23-8-10-24(11-9-23)35-33(37)39-21(2)22-6-7-22;1-3-38-22-13-14-23-24(15-22)36(21-5-4-6-21)27(26(23)28-35-25(16-40-28)30(31,32)33)19-9-11-20(12-10-19)34-29(37)39-17(2)18-7-8-18/h9-14,19,22-23,26-27H,4-8,15-18H2,1-3H3,(H,36,38);9-14,19,21,23,26-27H,4-8,15-18H2,1-3H3,(H,36,38);8-13,18-19,21-22,25-26H,3-7,14-17H2,1-2H3,(H,35,37);9-18,21H,3-8H2,1-2H3,(H,34,37)
• InChIKey: IRCCLBDFSMUYRH-UHFFFAOYSA-N
• XLogP: 34.18
• TPSA: 302.35 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 27
• Rotatable Bonds: 32
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2296.86
LogP ≤ 5	34.18
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	27

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-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?

The IUPAC name of 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate (CID 158781149) is 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate.

What is the SMILES notation for 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?

The canonical SMILES for 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate is CCOc1ccc2c(-c3nc(C(F)(F)F)cs3)c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c2c1.Cc1csc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)n1.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)oc1C.Cc1nc(-c2c(-c3ccc(NC(=O)OC(C)C4CC4)cc3)n(C3CCC3)c3cc(OC4CCOCC4)ccc23)sc1C.

What is the InChIKey of 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?

The InChIKey is IRCCLBDFSMUYRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H39N3O5.C34H39N3O4S.C33H37N3O4S.C30H30F3N3O3S/c1-20-21(2)40-33(35-20)31-29-14-13-28(42-27-15-17-39-18-16-27)19-30(29)37(26-5-4-6-26)32(31)24-9-11-25(12-10-24)36-34(38)41-22(3)23-7-8-23;1-20-22(3)42-33(35-20)31-29-14-13-28(41-27-15-17-39-18-16-27)19-30(29)37(26-5-4-6-26)32(31)24-9-11-25(12-10-24)36-34(38)40-21(2)23-7-8-23;1-20-19-41-32(34-20)30-28-13-12-27(40-26-14-16-38-17-15-26)18-29(28)36(25-4-3-5-25)31(30)23-8-10-24(11-9-23)35-33(37)39-21(2)22-6-7-22;1-3-38-22-13-14-23-24(15-22)36(21-5-4-6-21)27(26(23)28-35-25(16-40-28)30(31,32)33)19-9-11-20(12-10-19)34-29(37)39-17(2)18-7-8-18/h9-14,19,22-23,26-27H,4-8,15-18H2,1-3H3,(H,36,38);9-14,19,21,23,26-27H,4-8,15-18H2,1-3H3,(H,36,38);8-13,18-19,21-22,25-26H,3-7,14-17H2,1-2H3,(H,35,37);9-18,21H,3-8H2,1-2H3,(H,34,37).

What are the key properties of 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate?

1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate has a molecular weight of 2296.86 g/mol, XLogP of 34.18, 32 rotatable bonds, 4 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-oxazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-6-ethoxy-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]indol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[1-cyclobutyl-3-(4-methyl-1,3-thiazol-2-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 158781149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).