5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid

C14H15N3O5 — CID 75368294

About 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid

5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid (PubChem CID 75368294) has the molecular formula C14H15N3O5 and a molecular weight of 305.29 g/mol. Its IUPAC name is 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid.

Molecular Properties

• Compound Name: 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid
• PubChem CID: 75368294
• Molecular Formula: C14H15N3O5
• Molecular Weight: 305.29 g/mol
• Exact Mass: 305.10
• IUPAC Name: 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid
• SMILES: COCC(=O)N[C@H](C)c1onc(-c2cccnc2)c1C(=O)O
• InChI: InChI=1S/C14H15N3O5/c1-8(16-10(18)7-21-2)13-11(14(19)20)12(17-22-13)9-4-3-5-15-6-9/h3-6,8H,7H2,1-2H3,(H,16,18)(H,19,20)/t8-/m1/s1
• InChIKey: BLQFOFIPERVOIC-MRVPVSSYSA-N
• XLogP: 1.26
• TPSA: 114.55 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	305.29
LogP ≤ 5	1.26
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid?

The IUPAC name of 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid (CID 75368294) is 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid.

What is the SMILES notation for 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid?

The canonical SMILES for 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid is COCC(=O)N[C@H](C)c1onc(-c2cccnc2)c1C(=O)O.

What is the InChIKey of 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid?

The InChIKey is BLQFOFIPERVOIC-MRVPVSSYSA-N. The full InChI is InChI=1S/C14H15N3O5/c1-8(16-10(18)7-21-2)13-11(14(19)20)12(17-22-13)9-4-3-5-15-6-9/h3-6,8H,7H2,1-2H3,(H,16,18)(H,19,20)/t8-/m1/s1.

What are the key properties of 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid?

5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid has a molecular weight of 305.29 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(1R)-1-[(2-methoxyacetyl)amino]ethyl]-3-pyridin-3-yl-1,2-oxazole-4-carboxylic acid is sourced from PubChem (CID 75368294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).