N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide

C128H116N26O7 — CID 158656394

About N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide

N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide (PubChem CID 158656394) has the molecular formula C128H116N26O7 and a molecular weight of 2130.51 g/mol. Its IUPAC name is N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide
• PubChem CID: 158656394
• Molecular Formula: C128H116N26O7
• Molecular Weight: 2130.51 g/mol
• Exact Mass: 2128.95
• IUPAC Name: N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide
• SMILES: CCc1ccnn1Cc1ccc(C(=O)Nc2ccccc2N)cc1.Cc1cc(C(=O)Nc2ccccc2N)ccc1Cn1ncc(-c2ccccc2)c1C.Nc1ccc(-c2ccco2)cc1NC(=O)c1ccc(Cn2cccn2)cc1.Nc1ccccc1NC(=O)c1ccc(Cn2cc(-c3ccccc3)cn2)cc1.Nc1ccccc1NC(=O)c1ccc(Cn2nccc2-c2ccccn2)cc1.[C-]#[N+]c1ccn(Cc2ccc(C(=O)Nc3ccccc3N)cc2)n1
• InChI: InChI=1S/C25H24N4O.C23H20N4O.C22H19N5O.C21H18N4O2.C19H20N4O.C18H15N5O/c1-17-14-20(25(30)28-24-11-7-6-10-23(24)26)12-13-21(17)16-29-18(2)22(15-27-29)19-8-4-3-5-9-19;24-21-8-4-5-9-22(21)26-23(28)19-12-10-17(11-13-19)15-27-16-20(14-25-27)18-6-2-1-3-7-18;23-18-5-1-2-6-19(18)26-22(28)17-10-8-16(9-11-17)15-27-21(12-14-25-27)20-7-3-4-13-24-20;22-18-9-8-17(20-3-1-12-27-20)13-19(18)24-21(26)16-6-4-15(5-7-16)14-25-11-2-10-23-25;1-2-16-11-12-21-23(16)13-14-7-9-15(10-8-14)19(24)22-18-6-4-3-5-17(18)20;1-20-17-10-11-23(22-17)12-13-6-8-14(9-7-13)18(24)21-16-5-3-2-4-15(16)19/h3-15H,16,26H2,1-2H3,(H,28,30);1-14,16H,15,24H2,(H,26,28);1-14H,15,23H2,(H,26,28);1-13H,14,22H2,(H,24,26);3-12H,2,13,20H2,1H3,(H,22,24);2-11H,12,19H2,(H,21,24)
• InChIKey: ICEQBKNYTPGVNK-UHFFFAOYSA-N
• XLogP: 23.98
• TPSA: 468.03 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 26
• Rotatable Bonds: 29
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2130.51
LogP ≤ 5	23.98
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

The IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide (CID 158656394) is N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide.

What is the SMILES notation for N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

The canonical SMILES for N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide is CCc1ccnn1Cc1ccc(C(=O)Nc2ccccc2N)cc1.Cc1cc(C(=O)Nc2ccccc2N)ccc1Cn1ncc(-c2ccccc2)c1C.Nc1ccc(-c2ccco2)cc1NC(=O)c1ccc(Cn2cccn2)cc1.Nc1ccccc1NC(=O)c1ccc(Cn2cc(-c3ccccc3)cn2)cc1.Nc1ccccc1NC(=O)c1ccc(Cn2nccc2-c2ccccn2)cc1.[C-]#[N+]c1ccn(Cc2ccc(C(=O)Nc3ccccc3N)cc2)n1.

What is the InChIKey of N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

The InChIKey is ICEQBKNYTPGVNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O.C23H20N4O.C22H19N5O.C21H18N4O2.C19H20N4O.C18H15N5O/c1-17-14-20(25(30)28-24-11-7-6-10-23(24)26)12-13-21(17)16-29-18(2)22(15-27-29)19-8-4-3-5-9-19;24-21-8-4-5-9-22(21)26-23(28)19-12-10-17(11-13-19)15-27-16-20(14-25-27)18-6-2-1-3-7-18;23-18-5-1-2-6-19(18)26-22(28)17-10-8-16(9-11-17)15-27-21(12-14-25-27)20-7-3-4-13-24-20;22-18-9-8-17(20-3-1-12-27-20)13-19(18)24-21(26)16-6-4-15(5-7-16)14-25-11-2-10-23-25;1-2-16-11-12-21-23(16)13-14-7-9-15(10-8-14)19(24)22-18-6-4-3-5-17(18)20;1-20-17-10-11-23(22-17)12-13-6-8-14(9-7-13)18(24)21-16-5-3-2-4-15(16)19/h3-15H,16,26H2,1-2H3,(H,28,30);1-14,16H,15,24H2,(H,26,28);1-14H,15,23H2,(H,26,28);1-13H,14,22H2,(H,24,26);3-12H,2,13,20H2,1H3,(H,22,24);2-11H,12,19H2,(H,21,24).

What are the key properties of N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide has a molecular weight of 2130.51 g/mol, XLogP of 23.98, 29 rotatable bonds, 12 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide;N-(2-aminophenyl)-4-[(5-ethylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(3-isocyanopyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-3-methyl-4-[(5-methyl-4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(4-phenylpyrazol-1-yl)methyl]benzamide;N-(2-aminophenyl)-4-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide is sourced from PubChem (CID 158656394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).