N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane

C26H31N7O6 — CID 145402166

About N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane

N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane (PubChem CID 145402166) has the molecular formula C26H31N7O6 and a molecular weight of 537.58 g/mol. Its IUPAC name is N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane.

Molecular Properties

• Compound Name: N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane
• PubChem CID: 145402166
• Molecular Formula: C26H31N7O6
• Molecular Weight: 537.58 g/mol
• Exact Mass: 537.23
• IUPAC Name: N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane
• SMILES: CC1COC(=O)N1Cc1cc2c(nc1C=O)N(C(=O)Nc1cc(N)c(C#N)cn1)CCC2.COC1CCOC1
• InChI: InChI=1S/C21H21N7O4.C5H10O2/c1-12-11-32-21(31)28(12)9-14-5-13-3-2-4-27(19(13)25-17(14)10-29)20(30)26-18-6-16(23)15(7-22)8-24-18;1-6-5-2-3-7-4-5/h5-6,8,10,12H,2-4,9,11H2,1H3,(H3,23,24,26,30);5H,2-4H2,1H3
• InChIKey: LTGDJTKNIPUNJK-UHFFFAOYSA-N
• XLogP: 2.49
• TPSA: 173.00 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 10
• Rotatable Bonds: 5
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	537.58
LogP ≤ 5	2.49
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane?

The IUPAC name of N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane (CID 145402166) is N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane.

What is the SMILES notation for N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane?

The canonical SMILES for N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane is CC1COC(=O)N1Cc1cc2c(nc1C=O)N(C(=O)Nc1cc(N)c(C#N)cn1)CCC2.COC1CCOC1.

What is the InChIKey of N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane?

The InChIKey is LTGDJTKNIPUNJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N7O4.C5H10O2/c1-12-11-32-21(31)28(12)9-14-5-13-3-2-4-27(19(13)25-17(14)10-29)20(30)26-18-6-16(23)15(7-22)8-24-18;1-6-5-2-3-7-4-5/h5-6,8,10,12H,2-4,9,11H2,1H3,(H3,23,24,26,30);5H,2-4H2,1H3.

What are the key properties of N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane?

N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane has a molecular weight of 537.58 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-amino-5-cyano-2-pyridinyl)-7-formyl-6-[(4-methyl-2-oxo-1,3-oxazolidin-3-yl)methyl]-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide;3-methoxyoxolane is sourced from PubChem (CID 145402166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).