6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one

C25H25FN4O5 — CID 158341430

IUPAC6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one
SMILESCn1c(=O)ccc2ncc(F)c(CCCCCC3CN(c4ccc5c(n4)CC(=O)CO5)C(=O)O3)c21
InChIInChI=1S/C25H25FN4O5/c1-29-23(32)10-7-19-24(29)17(18(26)12-27-19)6-4-2-3-5-16-13-30(25(33)35-16)22-9-8-21-20(28-22)11-15(31)14-34-21/h7-10,12,16H,2-6,11,13-14H2,1H3
InChIKeyGRFCFHPCZGMAGN-UHFFFAOYSA-N
MW480.50 g/mol
LogP3.10
Rot. Bonds7

About 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one

6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one (PubChem CID 158341430) has the molecular formula C25H25FN4O5 and a molecular weight of 480.50 g/mol. Its IUPAC name is 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one.

Molecular Properties

Compound Name6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one
PubChem CID158341430
Molecular FormulaC25H25FN4O5
Molecular Weight480.50 g/mol
Exact Mass480.18
IUPAC Name6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one
SMILESCn1c(=O)ccc2ncc(F)c(CCCCCC3CN(c4ccc5c(n4)CC(=O)CO5)C(=O)O3)c21
InChIInChI=1S/C25H25FN4O5/c1-29-23(32)10-7-19-24(29)17(18(26)12-27-19)6-4-2-3-5-16-13-30(25(33)35-16)22-9-8-21-20(28-22)11-15(31)14-34-21/h7-10,12,16H,2-6,11,13-14H2,1H3
InChIKeyGRFCFHPCZGMAGN-UHFFFAOYSA-N
XLogP3.10
TPSA103.62 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.50
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The IUPAC name of 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one (CID 158341430) is 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one.
What is the SMILES notation for 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The canonical SMILES for 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one is Cn1c(=O)ccc2ncc(F)c(CCCCCC3CN(c4ccc5c(n4)CC(=O)CO5)C(=O)O3)c21.
What is the InChIKey of 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The InChIKey is GRFCFHPCZGMAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25FN4O5/c1-29-23(32)10-7-19-24(29)17(18(26)12-27-19)6-4-2-3-5-16-13-30(25(33)35-16)22-9-8-21-20(28-22)11-15(31)14-34-21/h7-10,12,16H,2-6,11,13-14H2,1H3.
What are the key properties of 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one?
6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one has a molecular weight of 480.50 g/mol, XLogP of 3.10, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-[5-(3-fluoro-5-methyl-6-oxo-1,5-naphthyridin-4-yl)pentyl]-2-oxo-1,3-oxazolidin-3-yl]-4H-pyrano[3,2-b]pyridin-3-one is sourced from PubChem (CID 158341430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).