2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide

C20H21N3O3 — CID 41042462

About 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide (PubChem CID 41042462) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide.

Molecular Properties

• Compound Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide
• PubChem CID: 41042462
• Molecular Formula: C20H21N3O3
• Molecular Weight: 351.41 g/mol
• Exact Mass: 351.16
• IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide
• SMILES: Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)c1ccccn1
• InChI: InChI=1S/C20H21N3O3/c1-13-17(15(3)26-23-13)12-25-19-10-5-4-8-16(19)20(24)22-14(2)18-9-6-7-11-21-18/h4-11,14H,12H2,1-3H3,(H,22,24)/t14-/m1/s1
• InChIKey: HBTNWVGZXOICMW-CQSZACIVSA-N
• XLogP: 3.76
• TPSA: 77.25 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	351.41
LogP ≤ 5	3.76
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide?

The IUPAC name of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide (CID 41042462) is 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide.

What is the SMILES notation for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide?

The canonical SMILES for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide is Cc1noc(C)c1COc1ccccc1C(=O)N[C@H](C)c1ccccn1.

What is the InChIKey of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide?

The InChIKey is HBTNWVGZXOICMW-CQSZACIVSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-13-17(15(3)26-23-13)12-25-19-10-5-4-8-16(19)20(24)22-14(2)18-9-6-7-11-21-18/h4-11,14H,12H2,1-3H3,(H,22,24)/t14-/m1/s1.

What are the key properties of 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide?

2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide has a molecular weight of 351.41 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(1R)-1-pyridin-2-ylethyl]benzamide is sourced from PubChem (CID 41042462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).