3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine

C76H69FN22O — CID 157152862

About 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine

3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine (PubChem CID 157152862) has the molecular formula C76H69FN22O and a molecular weight of 1325.54 g/mol. Its IUPAC name is 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine.

Molecular Properties

• Compound Name: 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine
• PubChem CID: 157152862
• Molecular Formula: C76H69FN22O
• Molecular Weight: 1325.54 g/mol
• Exact Mass: 1324.60
• IUPAC Name: 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine
• SMILES: CNCc1cccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.NC(=O)c1ccc2[nH]nc(-c3cccc(CNC4CC4)c3F)c2c1.c1cc(CNC2CC2)cc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.c1ccc(NCc2cccc(-c3n[nH]c4ccc(-c5ncn[nH]5)cc34)c2)cc1
• InChI: InChI=1S/C22H18N6.C19H18N6.C18H17FN4O.C17H16N6/c1-2-7-18(8-3-1)23-13-15-5-4-6-16(11-15)21-19-12-17(22-24-14-25-28-22)9-10-20(19)26-27-21;1-2-12(10-20-15-5-6-15)8-13(3-1)18-16-9-14(19-21-11-22-25-19)4-7-17(16)23-24-18;19-16-11(9-21-12-5-6-12)2-1-3-13(16)17-14-8-10(18(20)24)4-7-15(14)22-23-17;1-18-9-11-3-2-4-12(7-11)16-14-8-13(17-19-10-20-23-17)5-6-15(14)21-22-16/h1-12,14,23H,13H2,(H,26,27)(H,24,25,28);1-4,7-9,11,15,20H,5-6,10H2,(H,23,24)(H,21,22,25);1-4,7-8,12,21H,5-6,9H2,(H2,20,24)(H,22,23);2-8,10,18H,9H2,1H3,(H,21,22)(H,19,20,23)
• InChIKey: ALLOWKYSYAWBBF-UHFFFAOYSA-N
• XLogP: 13.35
• TPSA: 330.64 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 15
• Rotatable Bonds: 19
• Heavy Atoms: 100
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1325.54
LogP ≤ 5	13.35
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine?

The IUPAC name of 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine (CID 157152862) is 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine.

What is the SMILES notation for 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine?

The canonical SMILES for 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine is CNCc1cccc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.NC(=O)c1ccc2[nH]nc(-c3cccc(CNC4CC4)c3F)c2c1.c1cc(CNC2CC2)cc(-c2n[nH]c3ccc(-c4ncn[nH]4)cc23)c1.c1ccc(NCc2cccc(-c3n[nH]c4ccc(-c5ncn[nH]5)cc34)c2)cc1.

What is the InChIKey of 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine?

The InChIKey is ALLOWKYSYAWBBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N6.C19H18N6.C18H17FN4O.C17H16N6/c1-2-7-18(8-3-1)23-13-15-5-4-6-16(11-15)21-19-12-17(22-24-14-25-28-22)9-10-20(19)26-27-21;1-2-12(10-20-15-5-6-15)8-13(3-1)18-16-9-14(19-21-11-22-25-19)4-7-17(16)23-24-18;19-16-11(9-21-12-5-6-12)2-1-3-13(16)17-14-8-10(18(20)24)4-7-15(14)22-23-17;1-18-9-11-3-2-4-12(7-11)16-14-8-13(17-19-10-20-23-17)5-6-15(14)21-22-16/h1-12,14,23H,13H2,(H,26,27)(H,24,25,28);1-4,7-9,11,15,20H,5-6,10H2,(H,23,24)(H,21,22,25);1-4,7-8,12,21H,5-6,9H2,(H2,20,24)(H,22,23);2-8,10,18H,9H2,1H3,(H,21,22)(H,19,20,23).

What are the key properties of 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine?

3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine has a molecular weight of 1325.54 g/mol, XLogP of 13.35, 19 rotatable bonds, 12 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[3-[(cyclopropylamino)methyl]-2-fluorophenyl]-1H-indazole-5-carboxamide;N-methyl-1-[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methanamine;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]aniline;N-[[3-[5-(1H-1,2,4-triazol-5-yl)-1H-indazol-3-yl]phenyl]methyl]cyclopropanamine is sourced from PubChem (CID 157152862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).