1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium

C10H12F2NOY- — CID 162194483

IUPAC1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium
SMILESC=C1C(OC)=CC(C)=[C-]N1CC(F)F.[Y]
InChIInChI=1S/C10H12F2NO.Y/c1-7-4-9(14-3)8(2)13(5-7)6-10(11)12;/h4,10H,2,6H2,1,3H3;/q-1;
InChIKeyALWUCJNKXUAMHC-UHFFFAOYSA-N
MW289.11 g/mol
LogP2.32
Rot. Bonds3

About 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium

1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium (PubChem CID 162194483) has the molecular formula C10H12F2NOY- and a molecular weight of 289.11 g/mol. Its IUPAC name is 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium.

Molecular Properties

Compound Name1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium
PubChem CID162194483
Molecular FormulaC10H12F2NOY-
Molecular Weight289.11 g/mol
Exact Mass289.00
IUPAC Name1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium
SMILESC=C1C(OC)=CC(C)=[C-]N1CC(F)F.[Y]
InChIInChI=1S/C10H12F2NO.Y/c1-7-4-9(14-3)8(2)13(5-7)6-10(11)12;/h4,10H,2,6H2,1,3H3;/q-1;
InChIKeyALWUCJNKXUAMHC-UHFFFAOYSA-N
XLogP2.32
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.11
LogP ≤ 52.32
H-Bond Donors ≤ 50
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 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The IUPAC name of 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium (CID 162194483) is 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium.
What is the SMILES notation for 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The canonical SMILES for 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium is C=C1C(OC)=CC(C)=[C-]N1CC(F)F.[Y].
What is the InChIKey of 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium?
The InChIKey is ALWUCJNKXUAMHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2NO.Y/c1-7-4-9(14-3)8(2)13(5-7)6-10(11)12;/h4,10H,2,6H2,1,3H3;/q-1;.
What are the key properties of 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium?
1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium has a molecular weight of 289.11 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoroethyl)-5-methoxy-3-methyl-6-methylidene-2H-pyridin-2-ide;yttrium is sourced from PubChem (CID 162194483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).