6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine

C51H52ClFN10O8S2 — CID 157266004

About 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine

6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine (PubChem CID 157266004) has the molecular formula C51H52ClFN10O8S2 and a molecular weight of 1051.62 g/mol. Its IUPAC name is 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine.

Molecular Properties

• Compound Name: 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine
• PubChem CID: 157266004
• Molecular Formula: C51H52ClFN10O8S2
• Molecular Weight: 1051.62 g/mol
• Exact Mass: 1050.31
• IUPAC Name: 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine
• SMILES: CCOc1cc2ncc(-c3cc(N)nc(F)c3)n2cc1S(=O)(=O)C(C)C.COc1cc2ncc(C(=O)Nc3ccccc3C)n2cc1S(=O)(=O)C(C)(C)C.O=C(Nc1ccccc1Cl)c1cnn2ccccc12
• InChI: InChI=1S/C20H23N3O4S.C17H19FN4O3S.C14H10ClN3O/c1-13-8-6-7-9-14(13)22-19(24)15-11-21-18-10-16(27-5)17(12-23(15)18)28(25,26)20(2,3)4;1-4-25-13-7-17-20-8-12(11-5-15(18)21-16(19)6-11)22(17)9-14(13)26(23,24)10(2)3;15-11-5-1-2-6-12(11)17-14(19)10-9-16-18-8-4-3-7-13(10)18/h6-12H,1-5H3,(H,22,24);5-10H,4H2,1-3H3,(H2,19,21);1-9H,(H,17,19)
• InChIKey: AXZSLIOGBAOTQI-UHFFFAOYSA-N
• XLogP: 9.41
• TPSA: 235.75 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 16
• Rotatable Bonds: 11
• Heavy Atoms: 73
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1051.62
LogP ≤ 5	9.41
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine?

The IUPAC name of 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine (CID 157266004) is 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine.

What is the SMILES notation for 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine?

The canonical SMILES for 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine is CCOc1cc2ncc(-c3cc(N)nc(F)c3)n2cc1S(=O)(=O)C(C)C.COc1cc2ncc(C(=O)Nc3ccccc3C)n2cc1S(=O)(=O)C(C)(C)C.O=C(Nc1ccccc1Cl)c1cnn2ccccc12.

What is the InChIKey of 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine?

The InChIKey is AXZSLIOGBAOTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4S.C17H19FN4O3S.C14H10ClN3O/c1-13-8-6-7-9-14(13)22-19(24)15-11-21-18-10-16(27-5)17(12-23(15)18)28(25,26)20(2,3)4;1-4-25-13-7-17-20-8-12(11-5-15(18)21-16(19)6-11)22(17)9-14(13)26(23,24)10(2)3;15-11-5-1-2-6-12(11)17-14(19)10-9-16-18-8-4-3-7-13(10)18/h6-12H,1-5H3,(H,22,24);5-10H,4H2,1-3H3,(H2,19,21);1-9H,(H,17,19).

What are the key properties of 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine?

6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine has a molecular weight of 1051.62 g/mol, XLogP of 9.41, 11 rotatable bonds, 3 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 6-tert-butylsulfonyl-7-methoxy-N-(2-methylphenyl)imidazo[1,2-a]pyridine-3-carboxamide;N-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide;4-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-6-fluoropyridin-2-amine is sourced from PubChem (CID 157266004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).