3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide

C26H28N4O4 — CID 66737457

About 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide

3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide (PubChem CID 66737457) has the molecular formula C26H28N4O4 and a molecular weight of 460.53 g/mol. Its IUPAC name is 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide.

Molecular Properties

• Compound Name: 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide
• PubChem CID: 66737457
• Molecular Formula: C26H28N4O4
• Molecular Weight: 460.53 g/mol
• Exact Mass: 460.21
• IUPAC Name: 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide
• SMILES: CCCc1ccc(N2C[C@@H](CN(C)C(=O)C=Cc3ccnc4ccc(OC)nc34)OC2=O)cc1
• InChI: InChI=1S/C26H28N4O4/c1-4-5-18-6-9-20(10-7-18)30-17-21(34-26(30)32)16-29(2)24(31)13-8-19-14-15-27-22-11-12-23(33-3)28-25(19)22/h6-15,21H,4-5,16-17H2,1-3H3/t21-/m1/s1
• InChIKey: LGEHWUAYFPFYQB-OAQYLSRUSA-N
• XLogP: 4.09
• TPSA: 84.86 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	460.53
LogP ≤ 5	4.09
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide?

The IUPAC name of 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide (CID 66737457) is 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide.

What is the SMILES notation for 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide?

The canonical SMILES for 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide is CCCc1ccc(N2C[C@@H](CN(C)C(=O)C=Cc3ccnc4ccc(OC)nc34)OC2=O)cc1.

What is the InChIKey of 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide?

The InChIKey is LGEHWUAYFPFYQB-OAQYLSRUSA-N. The full InChI is InChI=1S/C26H28N4O4/c1-4-5-18-6-9-20(10-7-18)30-17-21(34-26(30)32)16-29(2)24(31)13-8-19-14-15-27-22-11-12-23(33-3)28-25(19)22/h6-15,21H,4-5,16-17H2,1-3H3/t21-/m1/s1.

What are the key properties of 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide?

3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide has a molecular weight of 460.53 g/mol, XLogP of 4.09, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(6-methoxy-1,5-naphthyridin-4-yl)-N-methyl-N-[[(5R)-2-oxo-3-(4-propylphenyl)-1,3-oxazolidin-5-yl]methyl]prop-2-enamide is sourced from PubChem (CID 66737457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).