4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine

C160H177F4N33O4 — CID 163588116

About 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine

4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine (PubChem CID 163588116) has the molecular formula C160H177F4N33O4 and a molecular weight of 2702.39 g/mol. Its IUPAC name is 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine.

Molecular Properties

• Compound Name: 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine
• PubChem CID: 163588116
• Molecular Formula: C160H177F4N33O4
• Molecular Weight: 2702.39 g/mol
• Exact Mass: 2700.46
• IUPAC Name: 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine
• SMILES: CC(CCc1ccccc1)Nc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCCC2)n1.Cc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(OCCc3cnc[nH]3)n2)cc1.Cc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(OCc3cccnc3)n2)cc1.Cc1cccc(Cn2cnc(-c3ccc(F)cc3)c2-c2ccnc(N[C@@H](C)c3ccccc3)n2)c1.Fc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(NCCCN3CCOCC3)n2)cc1.Fc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(NCCN3CCOCC3)n2)cc1
• InChI: InChI=1S/C29H26FN5.C29H32FN5.C26H33FN6O.C26H27N5O.C25H31FN6O.C25H28N6O/c1-20-7-6-8-22(17-20)18-35-19-32-27(24-11-13-25(30)14-12-24)28(35)26-15-16-31-29(34-26)33-21(2)23-9-4-3-5-10-23;1-21(12-13-22-8-4-2-5-9-22)33-29-31-19-18-26(34-29)28-27(23-14-16-24(30)17-15-23)32-20-35(28)25-10-6-3-7-11-25;27-21-9-7-20(8-10-21)24-25(33(19-30-24)22-5-2-1-3-6-22)23-11-13-29-26(31-23)28-12-4-14-32-15-17-34-18-16-32;1-19-9-11-21(12-10-19)24-25(31(18-29-24)22-7-3-2-4-8-22)23-13-15-28-26(30-23)32-17-20-6-5-14-27-16-20;26-20-8-6-19(7-9-20)23-24(32(18-29-23)21-4-2-1-3-5-21)22-10-11-27-25(30-22)28-12-13-31-14-16-33-17-15-31;1-18-7-9-19(10-8-18)23-24(31(17-29-23)21-5-3-2-4-6-21)22-11-13-27-25(30-22)32-14-12-20-15-26-16-28-20/h3-17,19,21H,18H2,1-2H3,(H,31,33,34);2,4-5,8-9,14-21,25H,3,6-7,10-13H2,1H3,(H,31,33,34);7-11,13,19,22H,1-6,12,14-18H2,(H,28,29,31);5-6,9-16,18,22H,2-4,7-8,17H2,1H3;6-11,18,21H,1-5,12-17H2,(H,27,28,30);7-11,13,15-17,21H,2-6,12,14H2,1H3,(H,26,28)/t21-;;;;;/m0...../s1
• InChIKey: GNFMLBVOXRVMAZ-DHOIFHORSA-N
• XLogP: 33.90
• TPSA: 394.69 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 36
• Rotatable Bonds: 43
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2702.39
LogP ≤ 5	33.90
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine?

The IUPAC name of 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine (CID 163588116) is 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine.

What is the SMILES notation for 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine?

The canonical SMILES for 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine is CC(CCc1ccccc1)Nc1nccc(-c2c(-c3ccc(F)cc3)ncn2C2CCCCC2)n1.Cc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(OCCc3cnc[nH]3)n2)cc1.Cc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(OCc3cccnc3)n2)cc1.Cc1cccc(Cn2cnc(-c3ccc(F)cc3)c2-c2ccnc(N[C@@H](C)c3ccccc3)n2)c1.Fc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(NCCCN3CCOCC3)n2)cc1.Fc1ccc(-c2ncn(C3CCCCC3)c2-c2ccnc(NCCN3CCOCC3)n2)cc1.

What is the InChIKey of 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine?

The InChIKey is GNFMLBVOXRVMAZ-DHOIFHORSA-N. The full InChI is InChI=1S/C29H26FN5.C29H32FN5.C26H33FN6O.C26H27N5O.C25H31FN6O.C25H28N6O/c1-20-7-6-8-22(17-20)18-35-19-32-27(24-11-13-25(30)14-12-24)28(35)26-15-16-31-29(34-26)33-21(2)23-9-4-3-5-10-23;1-21(12-13-22-8-4-2-5-9-22)33-29-31-19-18-26(34-29)28-27(23-14-16-24(30)17-15-23)32-20-35(28)25-10-6-3-7-11-25;27-21-9-7-20(8-10-21)24-25(33(19-30-24)22-5-2-1-3-6-22)23-11-13-29-26(31-23)28-12-4-14-32-15-17-34-18-16-32;1-19-9-11-21(12-10-19)24-25(31(18-29-24)22-7-3-2-4-8-22)23-13-15-28-26(30-23)32-17-20-6-5-14-27-16-20;26-20-8-6-19(7-9-20)23-24(32(18-29-23)21-4-2-1-3-5-21)22-10-11-27-25(30-22)28-12-13-31-14-16-33-17-15-31;1-18-7-9-19(10-8-18)23-24(31(17-29-23)21-5-3-2-4-6-21)22-11-13-27-25(30-22)32-14-12-20-15-26-16-28-20/h3-17,19,21H,18H2,1-2H3,(H,31,33,34);2,4-5,8-9,14-21,25H,3,6-7,10-13H2,1H3,(H,31,33,34);7-11,13,19,22H,1-6,12,14-18H2,(H,28,29,31);5-6,9-16,18,22H,2-4,7-8,17H2,1H3;6-11,18,21H,1-5,12-17H2,(H,27,28,30);7-11,13,15-17,21H,2-6,12,14H2,1H3,(H,26,28)/t21-;;;;;/m0...../s1.

What are the key properties of 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine?

4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine has a molecular weight of 2702.39 g/mol, XLogP of 33.90, 43 rotatable bonds, 5 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(2-morpholin-4-ylethyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(3-morpholin-4-ylpropyl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-(4-phenylbutan-2-yl)pyrimidin-2-amine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-[2-(1H-imidazol-5-yl)ethoxy]pyrimidine;4-[3-cyclohexyl-5-(4-methylphenyl)imidazol-4-yl]-2-(pyridin-3-ylmethoxy)pyrimidine;4-[5-(4-fluorophenyl)-3-[(3-methylphenyl)methyl]imidazol-4-yl]-N-[(1S)-1-phenylethyl]pyrimidin-2-amine is sourced from PubChem (CID 163588116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).