6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one

C25H27N5O5 — CID 162251730

IUPAC6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one
SMILESCOc1ccc2ncc(=O)n(CCCCC[C@@H]3CC(=O)N(c4ccc5c(n4)CC(=O)CO5)C3)c2n1
InChIInChI=1S/C25H27N5O5/c1-34-22-9-6-18-25(28-22)29(24(33)13-26-18)10-4-2-3-5-16-11-23(32)30(14-16)21-8-7-20-19(27-21)12-17(31)15-35-20/h6-9,13,16H,2-5,10-12,14-15H2,1H3/t16-/m1/s1
InChIKeyIEFYTCFUWGSNKX-MRXNPFEDSA-N
MW477.52 g/mol
LogP2.31
Rot. Bonds8

About 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one

6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one (PubChem CID 162251730) has the molecular formula C25H27N5O5 and a molecular weight of 477.52 g/mol. Its IUPAC name is 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one.

Molecular Properties

Compound Name6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one
PubChem CID162251730
Molecular FormulaC25H27N5O5
Molecular Weight477.52 g/mol
Exact Mass477.20
IUPAC Name6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one
SMILESCOc1ccc2ncc(=O)n(CCCCC[C@@H]3CC(=O)N(c4ccc5c(n4)CC(=O)CO5)C3)c2n1
InChIInChI=1S/C25H27N5O5/c1-34-22-9-6-18-25(28-22)29(24(33)13-26-18)10-4-2-3-5-16-11-23(32)30(14-16)21-8-7-20-19(27-21)12-17(31)15-35-20/h6-9,13,16H,2-5,10-12,14-15H2,1H3/t16-/m1/s1
InChIKeyIEFYTCFUWGSNKX-MRXNPFEDSA-N
XLogP2.31
TPSA116.51 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.52
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The IUPAC name of 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one (CID 162251730) is 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one.
What is the SMILES notation for 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The canonical SMILES for 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one is COc1ccc2ncc(=O)n(CCCCC[C@@H]3CC(=O)N(c4ccc5c(n4)CC(=O)CO5)C3)c2n1.
What is the InChIKey of 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one?
The InChIKey is IEFYTCFUWGSNKX-MRXNPFEDSA-N. The full InChI is InChI=1S/C25H27N5O5/c1-34-22-9-6-18-25(28-22)29(24(33)13-26-18)10-4-2-3-5-16-11-23(32)30(14-16)21-8-7-20-19(27-21)12-17(31)15-35-20/h6-9,13,16H,2-5,10-12,14-15H2,1H3/t16-/m1/s1.
What are the key properties of 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one?
6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one has a molecular weight of 477.52 g/mol, XLogP of 2.31, 8 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4R)-4-[5-(6-methoxy-3-oxopyrido[2,3-b]pyrazin-4-yl)pentyl]-2-oxopyrrolidin-1-yl]-4H-pyrano[3,2-b]pyridin-3-one is sourced from PubChem (CID 162251730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).