N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide

C93H75F2N19O4S4 — CID 157234939

About N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide

N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide (PubChem CID 157234939) has the molecular formula C93H75F2N19O4S4 and a molecular weight of 1689.02 g/mol. Its IUPAC name is N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide.

Molecular Properties

• Compound Name: N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide
• PubChem CID: 157234939
• Molecular Formula: C93H75F2N19O4S4
• Molecular Weight: 1689.02 g/mol
• Exact Mass: 1687.51
• IUPAC Name: N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide
• SMILES: CNC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccc(F)cc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1
• InChI: InChI=1S/C29H22FN5OS.C23H18FN5OS.C23H19N5OS.C18H16N4OS/c30-22-8-3-18(4-9-22)20-5-10-23(31)24(15-20)34-27(36)19-1-6-21(7-2-19)29(11-12-29)28-35-26(17-37-28)25-16-32-13-14-33-25;24-16-5-6-17(25)18(11-16)28-21(30)14-1-3-15(4-2-14)23(7-8-23)22-29-20(13-31-22)19-12-26-9-10-27-19;24-17-3-1-2-4-18(17)27-21(29)15-5-7-16(8-6-15)23(9-10-23)22-28-20(14-30-22)19-13-25-11-12-26-19;1-19-16(23)12-2-4-13(5-3-12)18(6-7-18)17-22-15(11-24-17)14-10-20-8-9-21-14/h1-10,13-17H,11-12,31H2,(H,34,36);1-6,9-13H,7-8,25H2,(H,28,30);1-8,11-14H,9-10,24H2,(H,27,29);2-5,8-11H,6-7H2,1H3,(H,19,23)
• InChIKey: AUNGUHGZFLFIAN-UHFFFAOYSA-N
• XLogP: 18.53
• TPSA: 349.14 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 23
• Rotatable Bonds: 20
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1689.02
LogP ≤ 5	18.53
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide?

The IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide (CID 157234939) is N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide.

What is the SMILES notation for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide?

The canonical SMILES for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide is CNC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccc(F)cc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.Nc1ccccc1NC(=O)c1ccc(C2(c3nc(-c4cnccn4)cs3)CC2)cc1.

What is the InChIKey of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide?

The InChIKey is AUNGUHGZFLFIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H22FN5OS.C23H18FN5OS.C23H19N5OS.C18H16N4OS/c30-22-8-3-18(4-9-22)20-5-10-23(31)24(15-20)34-27(36)19-1-6-21(7-2-19)29(11-12-29)28-35-26(17-37-28)25-16-32-13-14-33-25;24-16-5-6-17(25)18(11-16)28-21(30)14-1-3-15(4-2-14)23(7-8-23)22-29-20(13-31-22)19-12-26-9-10-27-19;24-17-3-1-2-4-18(17)27-21(29)15-5-7-16(8-6-15)23(9-10-23)22-28-20(14-30-22)19-13-25-11-12-26-19;1-19-16(23)12-2-4-13(5-3-12)18(6-7-18)17-22-15(11-24-17)14-10-20-8-9-21-14/h1-10,13-17H,11-12,31H2,(H,34,36);1-6,9-13H,7-8,25H2,(H,28,30);1-8,11-14H,9-10,24H2,(H,27,29);2-5,8-11H,6-7H2,1H3,(H,19,23).

What are the key properties of N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide?

N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide has a molecular weight of 1689.02 g/mol, XLogP of 18.53, 20 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-amino-5-(4-fluorophenyl)phenyl]-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-amino-5-fluorophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-(2-aminophenyl)-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide;N-methyl-4-[1-(4-pyrazin-2-yl-1,3-thiazol-2-yl)cyclopropyl]benzamide is sourced from PubChem (CID 157234939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).