2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide

C92H85F6N15O9 — CID 167676425

About 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide

2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide (PubChem CID 167676425) has the molecular formula C92H85F6N15O9 and a molecular weight of 1658.78 g/mol. Its IUPAC name is 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide.

Molecular Properties

• Compound Name: 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide
• PubChem CID: 167676425
• Molecular Formula: C92H85F6N15O9
• Molecular Weight: 1658.78 g/mol
• Exact Mass: 1657.66
• IUPAC Name: 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide
• SMILES: C=CC(=O)NCc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1C1CCOC1.CCOc1nc(C(=O)N(C)Cc2cccc3cn[nH]c23)cn1-c1cccc(F)c1.CN(Cc1cccc2cn[nH]c12)C(=O)c1ccc(-c2cccc(F)c2)c(OC(F)(F)F)c1
• InChI: InChI=1S/C26H23FN4O2.C23H17F4N3O2.C22H25N3O3.C21H20FN5O2/c1-3-24(32)28-14-21-12-18(10-11-23(21)17-6-5-9-22(27)13-17)26(33)31(2)16-20-8-4-7-19-15-29-30-25(19)20;1-30(13-17-6-2-5-16-12-28-29-21(16)17)22(31)15-8-9-19(14-4-3-7-18(24)10-14)20(11-15)32-23(25,26)27;1-3-28-20-11-15(7-8-19(20)18-9-10-27-14-18)22(26)25(2)13-17-6-4-5-16-12-23-24-21(16)17;1-3-29-21-24-18(13-27(21)17-9-5-8-16(22)10-17)20(28)26(2)12-15-7-4-6-14-11-23-25-19(14)15/h3-13,15H,1,14,16H2,2H3,(H,28,32)(H,29,30);2-12H,13H2,1H3,(H,28,29);4-8,11-12,18H,3,9-10,13-14H2,1-2H3,(H,23,24);4-11,13H,3,12H2,1-2H3,(H,23,25)
• InChIKey: UWOLHZRGCRBNKR-UHFFFAOYSA-N
• XLogP: 17.28
• TPSA: 279.80 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 15
• Rotatable Bonds: 24
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1658.78
LogP ≤ 5	17.28
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide?

The IUPAC name of 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide (CID 167676425) is 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide.

What is the SMILES notation for 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide?

The canonical SMILES for 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide is C=CC(=O)NCc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1-c1cccc(F)c1.CCOc1cc(C(=O)N(C)Cc2cccc3cn[nH]c23)ccc1C1CCOC1.CCOc1nc(C(=O)N(C)Cc2cccc3cn[nH]c23)cn1-c1cccc(F)c1.CN(Cc1cccc2cn[nH]c12)C(=O)c1ccc(-c2cccc(F)c2)c(OC(F)(F)F)c1.

What is the InChIKey of 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide?

The InChIKey is UWOLHZRGCRBNKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23FN4O2.C23H17F4N3O2.C22H25N3O3.C21H20FN5O2/c1-3-24(32)28-14-21-12-18(10-11-23(21)17-6-5-9-22(27)13-17)26(33)31(2)16-20-8-4-7-19-15-29-30-25(19)20;1-30(13-17-6-2-5-16-12-28-29-21(16)17)22(31)15-8-9-19(14-4-3-7-18(24)10-14)20(11-15)32-23(25,26)27;1-3-28-20-11-15(7-8-19(20)18-9-10-27-14-18)22(26)25(2)13-17-6-4-5-16-12-23-24-21(16)17;1-3-29-21-24-18(13-27(21)17-9-5-8-16(22)10-17)20(28)26(2)12-15-7-4-6-14-11-23-25-19(14)15/h3-13,15H,1,14,16H2,2H3,(H,28,32)(H,29,30);2-12H,13H2,1H3,(H,28,29);4-8,11-12,18H,3,9-10,13-14H2,1-2H3,(H,23,24);4-11,13H,3,12H2,1-2H3,(H,23,25).

What are the key properties of 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide?

2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide has a molecular weight of 1658.78 g/mol, XLogP of 17.28, 24 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-ethoxy-1-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methylimidazole-4-carboxamide;3-ethoxy-N-(1H-indazol-7-ylmethyl)-N-methyl-4-(oxolan-3-yl)benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-[(prop-2-enoylamino)methyl]benzamide;4-(3-fluorophenyl)-N-(1H-indazol-7-ylmethyl)-N-methyl-3-(trifluoromethoxy)benzamide is sourced from PubChem (CID 167676425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).