8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide

C22H25N3O4 — CID 69105851

About 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide

8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 69105851) has the molecular formula C22H25N3O4 and a molecular weight of 395.46 g/mol. Its IUPAC name is 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

• Compound Name: 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide
• PubChem CID: 69105851
• Molecular Formula: C22H25N3O4
• Molecular Weight: 395.46 g/mol
• Exact Mass: 395.18
• IUPAC Name: 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide
• SMILES: COc1cccc2c1C(Oc1cc(C(=O)N(C)C)cn3c(C)c(C)nc13)C(O)C2
• InChI: InChI=1S/C22H25N3O4/c1-12-13(2)25-11-15(22(27)24(3)4)10-18(21(25)23-12)29-20-16(26)9-14-7-6-8-17(28-5)19(14)20/h6-8,10-11,16,20,26H,9H2,1-5H3
• InChIKey: BANGIAGKGKLDRC-UHFFFAOYSA-N
• XLogP: 2.70
• TPSA: 76.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	395.46
LogP ≤ 5	2.70
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide?

The IUPAC name of 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide (CID 69105851) is 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide.

What is the SMILES notation for 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide?

The canonical SMILES for 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide is COc1cccc2c1C(Oc1cc(C(=O)N(C)C)cn3c(C)c(C)nc13)C(O)C2.

What is the InChIKey of 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide?

The InChIKey is BANGIAGKGKLDRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O4/c1-12-13(2)25-11-15(22(27)24(3)4)10-18(21(25)23-12)29-20-16(26)9-14-7-6-8-17(28-5)19(14)20/h6-8,10-11,16,20,26H,9H2,1-5H3.

What are the key properties of 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide?

8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 395.46 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-[(2-hydroxy-7-methoxy-2,3-dihydro-1H-inden-1-yl)oxy]-N,N,2,3-tetramethylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 69105851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).