6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C106H75Cl5F7N21O2 — CID 159117539

About 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 159117539) has the molecular formula C106H75Cl5F7N21O2 and a molecular weight of 1985.16 g/mol. Its IUPAC name is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

• Compound Name: 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
• PubChem CID: 159117539
• Molecular Formula: C106H75Cl5F7N21O2
• Molecular Weight: 1985.16 g/mol
• Exact Mass: 1981.47
• IUPAC Name: 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
• SMILES: CN1CCC(NC(=O)c2cnc3ccc(-c4cccnc4-c4cc(Cl)c(F)cc4F)cn23)CC1.CN1CCC(NC(=O)c2cnc3ccc(-c4cccnc4-c4cc(Cl)ccc4F)cn23)CC1.Fc1ccc(Cl)cc1-c1ncccc1-c1ccc2nccn2c1.[C-]#[N+]c1cnc2ccc(-c3cccnc3-c3cc(Cl)c(F)cc3F)cn12.[C-]#[N+]c1cnc2ccc(-c3cccnc3-c3cc(Cl)ccc3F)cn12
• InChI: InChI=1S/C25H22ClF2N5O.C25H23ClFN5O.C19H9ClF2N4.C19H10ClFN4.C18H11ClFN3/c1-32-9-6-16(7-10-32)31-25(34)22-13-30-23-5-4-15(14-33(22)23)17-3-2-8-29-24(17)18-11-19(26)21(28)12-20(18)27;1-31-11-8-18(9-12-31)30-25(33)22-14-29-23-7-4-16(15-32(22)23)19-3-2-10-28-24(19)20-13-17(26)5-6-21(20)27;1-23-18-9-25-17-5-4-11(10-26(17)18)12-3-2-6-24-19(12)13-7-14(20)16(22)8-15(13)21;1-22-18-10-24-17-7-4-12(11-25(17)18)14-3-2-8-23-19(14)15-9-13(20)5-6-16(15)21;19-13-4-5-16(20)15(10-13)18-14(2-1-7-22-18)12-3-6-17-21-8-9-23(17)11-12/h2-5,8,11-14,16H,6-7,9-10H2,1H3,(H,31,34);2-7,10,13-15,18H,8-9,11-12H2,1H3,(H,30,33);2-10H;2-11H;1-11H
• InChIKey: KFGULINJFJNKIE-UHFFFAOYSA-N
• XLogP: 25.31
• TPSA: 224.35 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 19
• Rotatable Bonds: 14
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1985.16
LogP ≤ 5	25.31
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	19

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?

The IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 159117539) is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

What is the SMILES notation for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?

The canonical SMILES for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is CN1CCC(NC(=O)c2cnc3ccc(-c4cccnc4-c4cc(Cl)c(F)cc4F)cn23)CC1.CN1CCC(NC(=O)c2cnc3ccc(-c4cccnc4-c4cc(Cl)ccc4F)cn23)CC1.Fc1ccc(Cl)cc1-c1ncccc1-c1ccc2nccn2c1.[C-]#[N+]c1cnc2ccc(-c3cccnc3-c3cc(Cl)c(F)cc3F)cn12.[C-]#[N+]c1cnc2ccc(-c3cccnc3-c3cc(Cl)ccc3F)cn12.

What is the InChIKey of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?

The InChIKey is KFGULINJFJNKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22ClF2N5O.C25H23ClFN5O.C19H9ClF2N4.C19H10ClFN4.C18H11ClFN3/c1-32-9-6-16(7-10-32)31-25(34)22-13-30-23-5-4-15(14-33(22)23)17-3-2-8-29-24(17)18-11-19(26)21(28)12-20(18)27;1-31-11-8-18(9-12-31)30-25(33)22-14-29-23-7-4-16(15-32(22)23)19-3-2-10-28-24(19)20-13-17(26)5-6-21(20)27;1-23-18-9-25-17-5-4-11(10-26(17)18)12-3-2-6-24-19(12)13-7-14(20)16(22)8-15(13)21;1-22-18-10-24-17-7-4-12(11-25(17)18)14-3-2-8-23-19(14)15-9-13(20)5-6-16(15)21;19-13-4-5-16(20)15(10-13)18-14(2-1-7-22-18)12-3-6-17-21-8-9-23(17)11-12/h2-5,8,11-14,16H,6-7,9-10H2,1H3,(H,31,34);2-7,10,13-15,18H,8-9,11-12H2,1H3,(H,30,33);2-10H;2-11H;1-11H.

What are the key properties of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?

6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 1985.16 g/mol, XLogP of 25.31, 14 rotatable bonds, 2 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-3-isocyanoimidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 159117539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).