ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium

C9H16NY- — CID 158409289

IUPACethane;methane;4-methyl-3H-pyridin-3-ide;yttrium
SMILESC.CC.Cc1[c-]cncc1.[Y]
InChIInChI=1S/C6H6N.C2H6.CH4.Y/c1-6-2-4-7-5-3-6;1-2;;/h2,4-5H,1H3;1-2H3;1H4;/q-1;;;
InChIKeyXQFFOPVYFQVOBB-UHFFFAOYSA-N
MW227.14 g/mol
LogP2.85
Rot. Bonds

About ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium

ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium (PubChem CID 158409289) has the molecular formula C9H16NY- and a molecular weight of 227.14 g/mol. Its IUPAC name is ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium.

Molecular Properties

Compound Nameethane;methane;4-methyl-3H-pyridin-3-ide;yttrium
PubChem CID158409289
Molecular FormulaC9H16NY-
Molecular Weight227.14 g/mol
Exact Mass227.03
IUPAC Nameethane;methane;4-methyl-3H-pyridin-3-ide;yttrium
SMILESC.CC.Cc1[c-]cncc1.[Y]
InChIInChI=1S/C6H6N.C2H6.CH4.Y/c1-6-2-4-7-5-3-6;1-2;;/h2,4-5H,1H3;1-2H3;1H4;/q-1;;;
InChIKeyXQFFOPVYFQVOBB-UHFFFAOYSA-N
XLogP2.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.14
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium?
The IUPAC name of ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium (CID 158409289) is ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium.
What is the SMILES notation for ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium?
The canonical SMILES for ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium is C.CC.Cc1[c-]cncc1.[Y].
What is the InChIKey of ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium?
The InChIKey is XQFFOPVYFQVOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N.C2H6.CH4.Y/c1-6-2-4-7-5-3-6;1-2;;/h2,4-5H,1H3;1-2H3;1H4;/q-1;;;.
What are the key properties of ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium?
ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium has a molecular weight of 227.14 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;4-methyl-3H-pyridin-3-ide;yttrium is sourced from PubChem (CID 158409289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).