2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione

C43H53F2N9O5 — CID 166472374

About 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione

2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione (PubChem CID 166472374) has the molecular formula C43H53F2N9O5 and a molecular weight of 813.95 g/mol. Its IUPAC name is 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione.

Molecular Properties

• Compound Name: 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
• PubChem CID: 166472374
• Molecular Formula: C43H53F2N9O5
• Molecular Weight: 813.95 g/mol
• Exact Mass: 813.41
• IUPAC Name: 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
• SMILES: CC(C)Oc1cc2nc(C3CCCCC3)cn2cc1C(=O)Nc1cccc(C(F)F)n1.CN(C)C1CCN(c2cccc3c2n(C)c(=O)n3C2CCC(=O)NC2=O)CC1
• InChI: InChI=1S/C23H26F2N4O2.C20H27N5O3/c1-14(2)31-19-11-21-27-18(15-7-4-3-5-8-15)13-29(21)12-16(19)23(30)28-20-10-6-9-17(26-20)22(24)25;1-22(2)13-9-11-24(12-10-13)14-5-4-6-15-18(14)23(3)20(28)25(15)16-7-8-17(26)21-19(16)27/h6,9-15,22H,3-5,7-8H2,1-2H3,(H,26,28,30);4-6,13,16H,7-12H2,1-3H3,(H,21,26,27)
• InChIKey: SLWUEZDPLVSZCX-UHFFFAOYSA-N
• XLogP: 6.60
• TPSA: 148.10 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 9
• Heavy Atoms: 59
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	813.95
LogP ≤ 5	6.60
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?

The IUPAC name of 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione (CID 166472374) is 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione.

What is the SMILES notation for 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?

The canonical SMILES for 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione is CC(C)Oc1cc2nc(C3CCCCC3)cn2cc1C(=O)Nc1cccc(C(F)F)n1.CN(C)C1CCN(c2cccc3c2n(C)c(=O)n3C2CCC(=O)NC2=O)CC1.

What is the InChIKey of 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?

The InChIKey is SLWUEZDPLVSZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26F2N4O2.C20H27N5O3/c1-14(2)31-19-11-21-27-18(15-7-4-3-5-8-15)13-29(21)12-16(19)23(30)28-20-10-6-9-17(26-20)22(24)25;1-22(2)13-9-11-24(12-10-13)14-5-4-6-15-18(14)23(3)20(28)25(15)16-7-8-17(26)21-19(16)27/h6,9-15,22H,3-5,7-8H2,1-2H3,(H,26,28,30);4-6,13,16H,7-12H2,1-3H3,(H,21,26,27).

What are the key properties of 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?

2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione has a molecular weight of 813.95 g/mol, XLogP of 6.60, 9 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 2-cyclohexyl-N-[6-(difluoromethyl)-2-pyridinyl]-7-propan-2-yloxyimidazo[1,2-a]pyridine-6-carboxamide;3-[4-[4-(dimethylamino)piperidin-1-yl]-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione is sourced from PubChem (CID 166472374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).