(5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide

C23H23N5O6 — CID 25113989

About (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide

(5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide (PubChem CID 25113989) has the molecular formula C23H23N5O6 and a molecular weight of 465.47 g/mol. Its IUPAC name is (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide.

Molecular Properties

• Compound Name: (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide
• PubChem CID: 25113989
• Molecular Formula: C23H23N5O6
• Molecular Weight: 465.47 g/mol
• Exact Mass: 465.16
• IUPAC Name: (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide
• SMILES: COc1ccc2nccc(NCCNC(=O)[C@H]3CN(c4ccc5c(c4)OCCO5)C(=O)O3)c2n1
• InChI: InChI=1S/C23H23N5O6/c1-31-20-5-3-15-21(27-20)16(6-7-24-15)25-8-9-26-22(29)19-13-28(23(30)34-19)14-2-4-17-18(12-14)33-11-10-32-17/h2-7,12,19H,8-11,13H2,1H3,(H,24,25)(H,26,29)/t19-/m1/s1
• InChIKey: OZIAYCSFXWCECS-LJQANCHMSA-N
• XLogP: 1.96
• TPSA: 124.14 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 9
• Rotatable Bonds: 7
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	465.47
LogP ≤ 5	1.96
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	9

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide?

The IUPAC name of (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide (CID 25113989) is (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide.

What is the SMILES notation for (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide?

The canonical SMILES for (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide is COc1ccc2nccc(NCCNC(=O)[C@H]3CN(c4ccc5c(c4)OCCO5)C(=O)O3)c2n1.

What is the InChIKey of (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide?

The InChIKey is OZIAYCSFXWCECS-LJQANCHMSA-N. The full InChI is InChI=1S/C23H23N5O6/c1-31-20-5-3-15-21(27-20)16(6-7-24-15)25-8-9-26-22(29)19-13-28(23(30)34-19)14-2-4-17-18(12-14)33-11-10-32-17/h2-7,12,19H,8-11,13H2,1H3,(H,24,25)(H,26,29)/t19-/m1/s1.

What are the key properties of (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide?

(5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide has a molecular weight of 465.47 g/mol, XLogP of 1.96, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for (5R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-[(6-methoxy-1,5-naphthyridin-4-yl)amino]ethyl]-2-oxo-1,3-oxazolidine-5-carboxamide is sourced from PubChem (CID 25113989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).