N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide

C95H103F3N22O6S — CID 158910429

About N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide

N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide (PubChem CID 158910429) has the molecular formula C95H103F3N22O6S and a molecular weight of 1738.08 g/mol. Its IUPAC name is N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide.

Molecular Properties

• Compound Name: N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide
• PubChem CID: 158910429
• Molecular Formula: C95H103F3N22O6S
• Molecular Weight: 1738.08 g/mol
• Exact Mass: 1736.81
• IUPAC Name: N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide
• SMILES: COc1cc2ncc(-n3cnc(-c4cc(C(=O)NC5CC5)c(F)cc4C)c3)n2cc1C1(F)CCN(C)CC1.Cc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc([C@@H]4CCN(C)C4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc(CO)n2C)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc(N3CCCCC3)s2)c1
• InChI: InChI=1S/C28H30F2N6O2.C26H27FN6O.C22H25N5OS.C19H21N5O2/c1-17-10-22(29)20(27(37)33-18-4-5-18)11-19(17)23-15-35(16-32-23)26-13-31-25-12-24(38-3)21(14-36(25)26)28(30)6-8-34(2)9-7-28;1-16-9-23(27)22(26(34)30-20-4-5-20)10-21(16)19-11-29-33(15-19)25-12-28-24-6-3-17(14-32(24)25)18-7-8-31(2)13-18;1-15-5-6-16(21(28)25-18-7-8-18)11-19(15)17-12-24-27(14-17)20-13-23-22(29-20)26-9-3-2-4-10-26;1-12-3-4-13(19(26)22-15-5-6-15)7-16(12)14-8-21-24(10-14)18-9-20-17(11-25)23(18)2/h10-16,18H,4-9H2,1-3H3,(H,33,37);3,6,9-12,14-15,18,20H,4-5,7-8,13H2,1-2H3,(H,30,34);5-6,11-14,18H,2-4,7-10H2,1H3,(H,25,28);3-4,7-10,15,25H,5-6,11H2,1-2H3,(H,22,26)/t;18-;;/m.1../s1
• InChIKey: JGOQKRBCZXYVTN-CRHNKEMKSA-N
• XLogP: 14.52
• TPSA: 292.17 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 25
• Rotatable Bonds: 21
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1738.08
LogP ≤ 5	14.52
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	25

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide?

The IUPAC name of N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide (CID 158910429) is N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide.

What is the SMILES notation for N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide?

The canonical SMILES for N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide is COc1cc2ncc(-n3cnc(-c4cc(C(=O)NC5CC5)c(F)cc4C)c3)n2cc1C1(F)CCN(C)CC1.Cc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc([C@@H]4CCN(C)C4)cn23)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc(CO)n2C)c1.Cc1ccc(C(=O)NC2CC2)cc1-c1cnn(-c2cnc(N3CCCCC3)s2)c1.

What is the InChIKey of N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide?

The InChIKey is JGOQKRBCZXYVTN-CRHNKEMKSA-N. The full InChI is InChI=1S/C28H30F2N6O2.C26H27FN6O.C22H25N5OS.C19H21N5O2/c1-17-10-22(29)20(27(37)33-18-4-5-18)11-19(17)23-15-35(16-32-23)26-13-31-25-12-24(38-3)21(14-36(25)26)28(30)6-8-34(2)9-7-28;1-16-9-23(27)22(26(34)30-20-4-5-20)10-21(16)19-11-29-33(15-19)25-12-28-24-6-3-17(14-32(24)25)18-7-8-31(2)13-18;1-15-5-6-16(21(28)25-18-7-8-18)11-19(15)17-12-24-27(14-17)20-13-23-22(29-20)26-9-3-2-4-10-26;1-12-3-4-13(19(26)22-15-5-6-15)7-16(12)14-8-21-24(10-14)18-9-20-17(11-25)23(18)2/h10-16,18H,4-9H2,1-3H3,(H,33,37);3,6,9-12,14-15,18,20H,4-5,7-8,13H2,1-2H3,(H,30,34);5-6,11-14,18H,2-4,7-10H2,1H3,(H,25,28);3-4,7-10,15,25H,5-6,11H2,1-2H3,(H,22,26)/t;18-;;/m.1../s1.

What are the key properties of N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide?

N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide has a molecular weight of 1738.08 g/mol, XLogP of 14.52, 21 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-2-fluoro-5-[1-[6-(4-fluoro-1-methylpiperidin-4-yl)-7-methoxyimidazo[1,2-a]pyridin-3-yl]imidazol-4-yl]-4-methylbenzamide;N-cyclopropyl-2-fluoro-4-methyl-5-[1-[6-[(3S)-1-methylpyrrolidin-3-yl]imidazo[1,2-a]pyridin-3-yl]pyrazol-4-yl]benzamide;N-cyclopropyl-3-[1-[2-(hydroxymethyl)-3-methylimidazol-4-yl]pyrazol-4-yl]-4-methylbenzamide;N-cyclopropyl-4-methyl-3-[1-(2-piperidin-1-yl-1,3-thiazol-5-yl)pyrazol-4-yl]benzamide is sourced from PubChem (CID 158910429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).