[3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol

C108H102F5N25O9 — CID 159426431

About [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol

[3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol (PubChem CID 159426431) has the molecular formula C108H102F5N25O9 and a molecular weight of 1989.16 g/mol. Its IUPAC name is [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol.

Molecular Properties

• Compound Name: [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
• PubChem CID: 159426431
• Molecular Formula: C108H102F5N25O9
• Molecular Weight: 1989.16 g/mol
• Exact Mass: 1987.82
• IUPAC Name: [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol
• SMILES: COCCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.COCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.OCCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.OCc1ccn2c(-c3ccnc(N4CCOCC4)n3)c(-c3ccc(F)cc3)nc2c1.OCc1ccn2c(-c3ccnc(NCC4CC4)n3)c(-c3ccc(F)cc3)nc2c1
• InChI: InChI=1S/C22H20FN5O2.C22H22FN5O2.C22H20FN5O.2C21H20FN5O2/c23-17-3-1-16(2-4-17)20-21(28-8-6-15(14-29)13-19(28)26-20)18-5-7-24-22(25-18)27-9-11-30-12-10-27;1-30-12-2-9-24-22-25-10-7-18(26-22)21-20(16-3-5-17(23)6-4-16)27-19-13-15(14-29)8-11-28(19)21;23-17-5-3-16(4-6-17)20-21(28-10-8-15(13-29)11-19(28)27-20)18-7-9-24-22(26-18)25-12-14-1-2-14;1-29-11-9-24-21-23-8-6-17(25-21)20-19(15-2-4-16(22)5-3-15)26-18-12-14(13-28)7-10-27(18)20;22-16-4-2-15(3-5-16)19-20(27-10-7-14(13-29)12-18(27)26-19)17-6-9-24-21(25-17)23-8-1-11-28/h1-8,13,29H,9-12,14H2;3-8,10-11,13,29H,2,9,12,14H2,1H3,(H,24,25,26);3-11,14,29H,1-2,12-13H2,(H,24,25,26);2-8,10,12,28H,9,11,13H2,1H3,(H,23,24,25);2-7,9-10,12,28-29H,1,8,11,13H2,(H,23,24,25)
• InChIKey: LQKKFDWFNACDGZ-UHFFFAOYSA-N
• XLogP: 16.41
• TPSA: 415.83 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 34
• Rotatable Bonds: 32
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1989.16
LogP ≤ 5	16.41
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?

The IUPAC name of [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol (CID 159426431) is [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol.

What is the SMILES notation for [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?

The canonical SMILES for [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol is COCCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.COCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.OCCCNc1nccc(-c2c(-c3ccc(F)cc3)nc3cc(CO)ccn23)n1.OCc1ccn2c(-c3ccnc(N4CCOCC4)n3)c(-c3ccc(F)cc3)nc2c1.OCc1ccn2c(-c3ccnc(NCC4CC4)n3)c(-c3ccc(F)cc3)nc2c1.

What is the InChIKey of [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?

The InChIKey is LQKKFDWFNACDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN5O2.C22H22FN5O2.C22H20FN5O.2C21H20FN5O2/c23-17-3-1-16(2-4-17)20-21(28-8-6-15(14-29)13-19(28)26-20)18-5-7-24-22(25-18)27-9-11-30-12-10-27;1-30-12-2-9-24-22-25-10-7-18(26-22)21-20(16-3-5-17(23)6-4-16)27-19-13-15(14-29)8-11-28(19)21;23-17-5-3-16(4-6-17)20-21(28-10-8-15(13-29)11-19(28)27-20)18-7-9-24-22(26-18)25-12-14-1-2-14;1-29-11-9-24-21-23-8-6-17(25-21)20-19(15-2-4-16(22)5-3-15)26-18-12-14(13-28)7-10-27(18)20;22-16-4-2-15(3-5-16)19-20(27-10-7-14(13-29)12-18(27)26-19)17-6-9-24-21(25-17)23-8-1-11-28/h1-8,13,29H,9-12,14H2;3-8,10-11,13,29H,2,9,12,14H2,1H3,(H,24,25,26);3-11,14,29H,1-2,12-13H2,(H,24,25,26);2-8,10,12,28H,9,11,13H2,1H3,(H,23,24,25);2-7,9-10,12,28-29H,1,8,11,13H2,(H,23,24,25).

What are the key properties of [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol?

[3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol has a molecular weight of 1989.16 g/mol, XLogP of 16.41, 32 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for [3-[2-(cyclopropylmethylamino)pyrimidin-4-yl]-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]methanol;3-[[4-[2-(4-fluorophenyl)-7-(hydroxymethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]propan-1-ol;[2-(4-fluorophenyl)-3-[2-(2-methoxyethylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-[2-(3-methoxypropylamino)pyrimidin-4-yl]imidazo[1,2-a]pyridin-7-yl]methanol;[2-(4-fluorophenyl)-3-(2-morpholin-4-ylpyrimidin-4-yl)imidazo[1,2-a]pyridin-7-yl]methanol is sourced from PubChem (CID 159426431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).