6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate

C64H66Br2F4N12O12 — CID 165094628

About 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate

6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate (PubChem CID 165094628) has the molecular formula C64H66Br2F4N12O12 and a molecular weight of 1431.10 g/mol. Its IUPAC name is 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate.

Molecular Properties

• Compound Name: 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate
• PubChem CID: 165094628
• Molecular Formula: C64H66Br2F4N12O12
• Molecular Weight: 1431.10 g/mol
• Exact Mass: 1428.32
• IUPAC Name: 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate
• SMILES: CC(C)(O)c1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1.COC(=O)c1cc(N)ncc1Br.COC(=O)c1cc2nc(C3CCOCC3)cn2cc1Br.COC(=O)c1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1
• InChI: InChI=1S/C22H24F2N4O3.C21H20F2N4O4.C14H15BrN2O3.C7H7BrN2O2/c1-22(2,30)14-10-19-26-17(13-6-8-31-9-7-13)11-28(19)12-18(14)27-21(29)16-5-3-4-15(25-16)20(23)24;1-30-21(29)13-9-18-25-16(12-5-7-31-8-6-12)10-27(18)11-17(13)26-20(28)15-4-2-3-14(24-15)19(22)23;1-19-14(18)10-6-13-16-12(8-17(13)7-11(10)15)9-2-4-20-5-3-9;1-12-7(11)4-2-6(9)10-3-5(4)8/h3-5,10-13,20,30H,6-9H2,1-2H3,(H,27,29);2-4,9-12,19H,5-8H2,1H3,(H,26,28);6-9H,2-5H2,1H3;2-3H,1H3,(H2,9,10)
• InChIKey: XHCHSHZJBKBJJZ-UHFFFAOYSA-N
• XLogP: 11.63
• TPSA: 301.61 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 13
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1431.10
LogP ≤ 5	11.63
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate?

The IUPAC name of 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate (CID 165094628) is 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate.

What is the SMILES notation for 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate?

The canonical SMILES for 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate is CC(C)(O)c1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1.COC(=O)c1cc(N)ncc1Br.COC(=O)c1cc2nc(C3CCOCC3)cn2cc1Br.COC(=O)c1cc2nc(C3CCOCC3)cn2cc1NC(=O)c1cccc(C(F)F)n1.

What is the InChIKey of 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate?

The InChIKey is XHCHSHZJBKBJJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24F2N4O3.C21H20F2N4O4.C14H15BrN2O3.C7H7BrN2O2/c1-22(2,30)14-10-19-26-17(13-6-8-31-9-7-13)11-28(19)12-18(14)27-21(29)16-5-3-4-15(25-16)20(23)24;1-30-21(29)13-9-18-25-16(12-5-7-31-8-6-12)10-27(18)11-17(13)26-20(28)15-4-2-3-14(24-15)19(22)23;1-19-14(18)10-6-13-16-12(8-17(13)7-11(10)15)9-2-4-20-5-3-9;1-12-7(11)4-2-6(9)10-3-5(4)8/h3-5,10-13,20,30H,6-9H2,1-2H3,(H,27,29);2-4,9-12,19H,5-8H2,1H3,(H,26,28);6-9H,2-5H2,1H3;2-3H,1H3,(H2,9,10).

What are the key properties of 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate?

6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate has a molecular weight of 1431.10 g/mol, XLogP of 11.63, 13 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(difluoromethyl)-N-[7-(2-hydroxypropan-2-yl)-2-(oxan-4-yl)imidazo[1,2-a]pyridin-6-yl]pyridine-2-carboxamide;methyl 2-amino-5-bromopyridine-4-carboxylate;methyl 6-bromo-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate;methyl 6-[[6-(difluoromethyl)pyridine-2-carbonyl]amino]-2-(oxan-4-yl)imidazo[1,2-a]pyridine-7-carboxylate is sourced from PubChem (CID 165094628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).