2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium

C8H9N2Y- — CID 59066814

IUPAC2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium
SMILES[Y].[c-]1ccc2c(n1)CCCN2
InChIInChI=1S/C8H9N2.Y/c1-3-7-8(9-5-1)4-2-6-10-7;/h1,3,10H,2,4,6H2;/q-1;
InChIKeyWDELCTUPNLOESH-UHFFFAOYSA-N
MW222.08 g/mol
LogP1.24
Rot. Bonds

About 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium

2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium (PubChem CID 59066814) has the molecular formula C8H9N2Y- and a molecular weight of 222.08 g/mol. Its IUPAC name is 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium.

Molecular Properties

Compound Name2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium
PubChem CID59066814
Molecular FormulaC8H9N2Y-
Molecular Weight222.08 g/mol
Exact Mass221.98
IUPAC Name2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium
SMILES[Y].[c-]1ccc2c(n1)CCCN2
InChIInChI=1S/C8H9N2.Y/c1-3-7-8(9-5-1)4-2-6-10-7;/h1,3,10H,2,4,6H2;/q-1;
InChIKeyWDELCTUPNLOESH-UHFFFAOYSA-N
XLogP1.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.08
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium?
The IUPAC name of 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium (CID 59066814) is 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium.
What is the SMILES notation for 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium?
The canonical SMILES for 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium is [Y].[c-]1ccc2c(n1)CCCN2.
What is the InChIKey of 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium?
The InChIKey is WDELCTUPNLOESH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N2.Y/c1-3-7-8(9-5-1)4-2-6-10-7;/h1,3,10H,2,4,6H2;/q-1;.
What are the key properties of 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium?
2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium has a molecular weight of 222.08 g/mol, XLogP of 1.24, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,6-tetrahydro-1H-1,5-naphthyridin-6-ide;yttrium is sourced from PubChem (CID 59066814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).