3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide

C114H99F6N21O15S — CID 158891630

About 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide

3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide (PubChem CID 158891630) has the molecular formula C114H99F6N21O15S and a molecular weight of 2149.23 g/mol. Its IUPAC name is 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide.

Molecular Properties

• Compound Name: 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
• PubChem CID: 158891630
• Molecular Formula: C114H99F6N21O15S
• Molecular Weight: 2149.23 g/mol
• Exact Mass: 2147.73
• IUPAC Name: 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide
• SMILES: COCCC(=O)Nc1cc2c(-c3cccc(F)c3)n[nH]c2cc1OC.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)Cc1cccnc1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)Cc1cccs1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)N(C)C.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)[C@H]1CCC(=O)N1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)c1ccco1
• InChI: InChI=1S/C21H17FN4O2.C20H16FN3O2S.C19H17FN4O3.C19H14FN3O3.C18H18FN3O3.C17H17FN4O2/c1-28-19-11-17-16(21(26-25-17)14-5-2-6-15(22)9-14)10-18(19)24-20(27)8-13-4-3-7-23-12-13;1-26-18-11-16-15(20(24-23-16)12-4-2-5-13(21)8-12)10-17(18)22-19(25)9-14-6-3-7-27-14;1-27-16-9-14-12(18(24-23-14)10-3-2-4-11(20)7-10)8-15(16)22-19(26)13-5-6-17(25)21-13;1-25-17-10-14-13(9-15(17)21-19(24)16-6-3-7-26-16)18(23-22-14)11-4-2-5-12(20)8-11;1-24-7-6-17(23)20-15-9-13-14(10-16(15)25-2)21-22-18(13)11-4-3-5-12(19)8-11;1-22(2)17(23)19-14-8-12-13(9-15(14)24-3)20-21-16(12)10-5-4-6-11(18)7-10/h2-7,9-12H,8H2,1H3,(H,24,27)(H,25,26);2-8,10-11H,9H2,1H3,(H,22,25)(H,23,24);2-4,7-9,13H,5-6H2,1H3,(H,21,25)(H,22,26)(H,23,24);2-10H,1H3,(H,21,24)(H,22,23);3-5,8-10H,6-7H2,1-2H3,(H,20,23)(H,21,22);4-9H,1-3H3,(H,19,23)(H,20,21)/t;;13-;;;/m..1.../s1
• InChIKey: JEHQVNCAPVKFIY-IEUDWUHUSA-N
• XLogP: 22.22
• TPSA: 469.66 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 23
• Rotatable Bonds: 27
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2149.23
LogP ≤ 5	22.22
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide?

The IUPAC name of 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide (CID 158891630) is 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide.

What is the SMILES notation for 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide?

The canonical SMILES for 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide is COCCC(=O)Nc1cc2c(-c3cccc(F)c3)n[nH]c2cc1OC.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)Cc1cccnc1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)Cc1cccs1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)N(C)C.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)[C@H]1CCC(=O)N1.COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)c1ccco1.

What is the InChIKey of 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide?

The InChIKey is JEHQVNCAPVKFIY-IEUDWUHUSA-N. The full InChI is InChI=1S/C21H17FN4O2.C20H16FN3O2S.C19H17FN4O3.C19H14FN3O3.C18H18FN3O3.C17H17FN4O2/c1-28-19-11-17-16(21(26-25-17)14-5-2-6-15(22)9-14)10-18(19)24-20(27)8-13-4-3-7-23-12-13;1-26-18-11-16-15(20(24-23-16)12-4-2-5-13(21)8-12)10-17(18)22-19(25)9-14-6-3-7-27-14;1-27-16-9-14-12(18(24-23-14)10-3-2-4-11(20)7-10)8-15(16)22-19(26)13-5-6-17(25)21-13;1-25-17-10-14-13(9-15(17)21-19(24)16-6-3-7-26-16)18(23-22-14)11-4-2-5-12(20)8-11;1-24-7-6-17(23)20-15-9-13-14(10-16(15)25-2)21-22-18(13)11-4-3-5-12(19)8-11;1-22(2)17(23)19-14-8-12-13(9-15(14)24-3)20-21-16(12)10-5-4-6-11(18)7-10/h2-7,9-12H,8H2,1H3,(H,24,27)(H,25,26);2-8,10-11H,9H2,1H3,(H,22,25)(H,23,24);2-4,7-9,13H,5-6H2,1H3,(H,21,25)(H,22,26)(H,23,24);2-10H,1H3,(H,21,24)(H,22,23);3-5,8-10H,6-7H2,1-2H3,(H,20,23)(H,21,22);4-9H,1-3H3,(H,19,23)(H,20,21)/t;;13-;;;/m..1.../s1.

What are the key properties of 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide?

3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide has a molecular weight of 2149.23 g/mol, XLogP of 22.22, 27 rotatable bonds, 13 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-1,1-dimethylurea;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]furan-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-3-methoxypropanamide;(2R)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-5-oxopyrrolidine-2-carboxamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide;N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 158891630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).