cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate

C117H137Cl4F5N18O12 — CID 158258147

About cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate

cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate (PubChem CID 158258147) has the molecular formula C117H137Cl4F5N18O12 and a molecular weight of 2224.30 g/mol. Its IUPAC name is cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate.

Molecular Properties

• Compound Name: cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate
• PubChem CID: 158258147
• Molecular Formula: C117H137Cl4F5N18O12
• Molecular Weight: 2224.30 g/mol
• Exact Mass: 2220.93
• IUPAC Name: cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate
• SMILES: CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OC5CCCCC5)C4)ncc3Cl)cc(F)c2nn1C.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OCC5CC5(C)F)C4)ncc3Cl)cc(F)c2nn1C.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OCc5ccn(C)n5)C4)ncc3Cl)cc(F)c2nn1C.COC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C(C)C)c4c3)c(Cl)cn2)C1
• InChI: InChI=1S/C31H38ClFN4O3.C30H35ClF2N4O3.C30H34ClFN6O3.C26H30ClFN4O3/c1-18(2)30-24-14-21(15-26(33)29(24)36-37(30)3)23-16-27(34-17-25(23)32)35-31(39)20-9-7-8-19(12-20)13-28(38)40-22-10-5-4-6-11-22;1-16(2)28-22-10-19(11-24(32)27(22)36-37(28)4)21-12-25(34-14-23(21)31)35-29(39)18-7-5-6-17(8-18)9-26(38)40-15-20-13-30(20,3)33;1-17(2)29-23-12-20(13-25(32)28(23)36-38(29)4)22-14-26(33-15-24(22)31)34-30(40)19-7-5-6-18(10-19)11-27(39)41-16-21-8-9-37(3)35-21;1-14(2)25-19-10-17(11-21(28)24(19)31-32(25)3)18-12-22(29-13-20(18)27)30-26(34)16-7-5-6-15(8-16)9-23(33)35-4/h14-20,22H,4-13H2,1-3H3,(H,34,35,39);10-12,14,16-18,20H,5-9,13,15H2,1-4H3,(H,34,35,39);8-9,12-15,17-19H,5-7,10-11,16H2,1-4H3,(H,33,34,40);10-16H,5-9H2,1-4H3,(H,29,30,34)/t19-,20+;17-,18+,20?,30?;18-,19+;15-,16+/m1111/s1
• InChIKey: GHNOXRZSRLFBKC-CPFCMSFNSA-N
• XLogP: 26.56
• TPSA: 362.26 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 26
• Rotatable Bonds: 29
• Heavy Atoms: 156
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2224.30
LogP ≤ 5	26.56
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate?

The IUPAC name of cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate (CID 158258147) is cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate.

What is the SMILES notation for cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate?

The canonical SMILES for cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate is CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OC5CCCCC5)C4)ncc3Cl)cc(F)c2nn1C.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OCC5CC5(C)F)C4)ncc3Cl)cc(F)c2nn1C.CC(C)c1c2cc(-c3cc(NC(=O)[C@H]4CCC[C@@H](CC(=O)OCc5ccn(C)n5)C4)ncc3Cl)cc(F)c2nn1C.COC(=O)C[C@@H]1CCC[C@H](C(=O)Nc2cc(-c3cc(F)c4nn(C)c(C(C)C)c4c3)c(Cl)cn2)C1.

What is the InChIKey of cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate?

The InChIKey is GHNOXRZSRLFBKC-CPFCMSFNSA-N. The full InChI is InChI=1S/C31H38ClFN4O3.C30H35ClF2N4O3.C30H34ClFN6O3.C26H30ClFN4O3/c1-18(2)30-24-14-21(15-26(33)29(24)36-37(30)3)23-16-27(34-17-25(23)32)35-31(39)20-9-7-8-19(12-20)13-28(38)40-22-10-5-4-6-11-22;1-16(2)28-22-10-19(11-24(32)27(22)36-37(28)4)21-12-25(34-14-23(21)31)35-29(39)18-7-5-6-17(8-18)9-26(38)40-15-20-13-30(20,3)33;1-17(2)29-23-12-20(13-25(32)28(23)36-38(29)4)22-14-26(33-15-24(22)31)34-30(40)19-7-5-6-18(10-19)11-27(39)41-16-21-8-9-37(3)35-21;1-14(2)25-19-10-17(11-21(28)24(19)31-32(25)3)18-12-22(29-13-20(18)27)30-26(34)16-7-5-6-15(8-16)9-23(33)35-4/h14-20,22H,4-13H2,1-3H3,(H,34,35,39);10-12,14,16-18,20H,5-9,13,15H2,1-4H3,(H,34,35,39);8-9,12-15,17-19H,5-7,10-11,16H2,1-4H3,(H,33,34,40);10-16H,5-9H2,1-4H3,(H,29,30,34)/t19-,20+;17-,18+,20?,30?;18-,19+;15-,16+/m1111/s1.

What are the key properties of cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate?

cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate has a molecular weight of 2224.30 g/mol, XLogP of 26.56, 29 rotatable bonds, 4 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for cyclohexyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(2-fluoro-2-methylcyclopropyl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate;(1-methylpyrazol-3-yl)methyl 2-[(1R,3S)-3-[[5-chloro-4-(7-fluoro-2-methyl-3-propan-2-ylindazol-5-yl)-2-pyridinyl]carbamoyl]cyclohexyl]acetate is sourced from PubChem (CID 158258147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).