N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

C26H29N5O3S — CID 55510229

About N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (PubChem CID 55510229) has the molecular formula C26H29N5O3S and a molecular weight of 491.62 g/mol. Its IUPAC name is N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

Molecular Properties

• Compound Name: N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
• PubChem CID: 55510229
• Molecular Formula: C26H29N5O3S
• Molecular Weight: 491.62 g/mol
• Exact Mass: 491.20
• IUPAC Name: N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide
• SMILES: Cc1ccc2nc(COc3cccc(C(=O)Nc4nc(CN5CC(C)OC(C)C5)cs4)c3)cn2c1
• InChI: InChI=1S/C26H29N5O3S/c1-17-7-8-24-27-21(14-31(24)10-17)15-33-23-6-4-5-20(9-23)25(32)29-26-28-22(16-35-26)13-30-11-18(2)34-19(3)12-30/h4-10,14,16,18-19H,11-13,15H2,1-3H3,(H,28,29,32)
• InChIKey: OLYZJFIDVNQWKW-UHFFFAOYSA-N
• XLogP: 4.54
• TPSA: 80.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 8
• Rotatable Bonds: 7
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	491.62
LogP ≤ 5	4.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The IUPAC name of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide (CID 55510229) is N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide.

What is the SMILES notation for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The canonical SMILES for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is Cc1ccc2nc(COc3cccc(C(=O)Nc4nc(CN5CC(C)OC(C)C5)cs4)c3)cn2c1.

What is the InChIKey of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

The InChIKey is OLYZJFIDVNQWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29N5O3S/c1-17-7-8-24-27-21(14-31(24)10-17)15-33-23-6-4-5-20(9-23)25(32)29-26-28-22(16-35-26)13-30-11-18(2)34-19(3)12-30/h4-10,14,16,18-19H,11-13,15H2,1-3H3,(H,28,29,32).

What are the key properties of N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide?

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide has a molecular weight of 491.62 g/mol, XLogP of 4.54, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-[(6-methylimidazo[1,2-a]pyridin-2-yl)methoxy]benzamide is sourced from PubChem (CID 55510229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).