N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide

C108H96N22O7 — CID 158406842

About N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide

N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide (PubChem CID 158406842) has the molecular formula C108H96N22O7 and a molecular weight of 1814.10 g/mol. Its IUPAC name is N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide.

Molecular Properties

• Compound Name: N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide
• PubChem CID: 158406842
• Molecular Formula: C108H96N22O7
• Molecular Weight: 1814.10 g/mol
• Exact Mass: 1812.78
• IUPAC Name: N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide
• SMILES: Cc1cc(C(=O)Nc2ccccc2N)ccc1Cn1ncc(-c2ccccc2)c1C.Cc1cnn(Cc2ccc(C(=O)Nc3cc(-c4ccco4)ccc3N)cc2)c1.Nc1ccc(-c2ccco2)cc1NC(=O)c1ccc(Cn2cccn2)cc1.Nc1ccccc1NC(=O)c1ccc(Cn2nccc2-c2ccccn2)cc1.[C-]#[N+]c1ccn(Cc2ccc(C(=O)Nc3ccccc3N)cc2)n1
• InChI: InChI=1S/C25H24N4O.C22H19N5O.C22H20N4O2.C21H18N4O2.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;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;1-15-12-24-26(13-15)14-16-4-6-17(7-5-16)22(27)25-20-11-18(8-9-19(20)23)21-3-2-10-28-21;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;1-20-17-10-11-23(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);1-14H,15,23H2,(H,26,28);2-13H,14,23H2,1H3,(H,25,27);1-13H,14,22H2,(H,24,26);2-11H,12,19H2,(H,21,24)
• InChIKey: GYUQNUCWRDDWNA-UHFFFAOYSA-N
• XLogP: 20.55
• TPSA: 408.23 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 23
• Rotatable Bonds: 24
• Heavy Atoms: 137
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1814.10
LogP ≤ 5	20.55
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	23

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-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

The IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide (CID 158406842) is N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide.

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

The canonical SMILES for N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide is Cc1cc(C(=O)Nc2ccccc2N)ccc1Cn1ncc(-c2ccccc2)c1C.Cc1cnn(Cc2ccc(C(=O)Nc3cc(-c4ccco4)ccc3N)cc2)c1.Nc1ccc(-c2ccco2)cc1NC(=O)c1ccc(Cn2cccn2)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-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide?

The InChIKey is GYUQNUCWRDDWNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O.C22H19N5O.C22H20N4O2.C21H18N4O2.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;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;1-15-12-24-26(13-15)14-16-4-6-17(7-5-16)22(27)25-20-11-18(8-9-19(20)23)21-3-2-10-28-21;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;1-20-17-10-11-23(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);1-14H,15,23H2,(H,26,28);2-13H,14,23H2,1H3,(H,25,27);1-13H,14,22H2,(H,24,26);2-11H,12,19H2,(H,21,24).

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

N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide has a molecular weight of 1814.10 g/mol, XLogP of 20.55, 24 rotatable bonds, 10 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-amino-5-(furan-2-yl)phenyl]-4-[(4-methylpyrazol-1-yl)methyl]benzamide;N-[2-amino-5-(furan-2-yl)phenyl]-4-(pyrazol-1-ylmethyl)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-[(5-pyridin-2-ylpyrazol-1-yl)methyl]benzamide is sourced from PubChem (CID 158406842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).