1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium

C9H12NO2Y- — CID 59959839

IUPAC1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium
SMILESC[CH-]n1c(C)cc(O)c(C)c1=O.[Y]
InChIInChI=1S/C9H12NO2.Y/c1-4-10-6(2)5-8(11)7(3)9(10)12;/h4-5,11H,1-3H3;/q-1;
InChIKeyFGKULVBYRHKBER-UHFFFAOYSA-N
MW255.11 g/mol
LogP1.20
Rot. Bonds1

About 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium

1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium (PubChem CID 59959839) has the molecular formula C9H12NO2Y- and a molecular weight of 255.11 g/mol. Its IUPAC name is 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium.

Molecular Properties

Compound Name1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium
PubChem CID59959839
Molecular FormulaC9H12NO2Y-
Molecular Weight255.11 g/mol
Exact Mass254.99
IUPAC Name1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium
SMILESC[CH-]n1c(C)cc(O)c(C)c1=O.[Y]
InChIInChI=1S/C9H12NO2.Y/c1-4-10-6(2)5-8(11)7(3)9(10)12;/h4-5,11H,1-3H3;/q-1;
InChIKeyFGKULVBYRHKBER-UHFFFAOYSA-N
XLogP1.20
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.11
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-Hydroxy-1,6-dimethyl-1,2-dihydropyridin-2-one
CID 54676118
1-ethyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54680702
1-Cyclopropyl-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one
CID 54704852
1-Butyl-4-hydroxy-6-(trifluoromethyl)pyridin-2-one
CID 172416749
4-Hydroxy-1-propyl-6-(trifluoromethyl)pyridin-2-one
CID 172416750
4-Hydroxy-1-(2-methylpropyl)-6-(trifluoromethyl)pyridin-2-one
CID 172416751
7-Hydroxy-3-methylquinolizin-4-one
CID 21364158
4-Hydroxy-6-methyl-1-propylpyridin-2(1H)-one
CID 54678658
1-allyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54687827
1-Cyclopropylmethyl-4-hydroxy-6-methyl-1H-pyridin-2-one
CID 54703058
1-Butyl-4-hydroxy-6-methylpyridin-2-one
CID 54710228
1-cyclohexyl-4-hydroxy-3,6-dimethyl-1H-pyridin-2-one
CID 54724191

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium?
The IUPAC name of 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium (CID 59959839) is 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium.
What is the SMILES notation for 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium?
The canonical SMILES for 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium is C[CH-]n1c(C)cc(O)c(C)c1=O.[Y].
What is the InChIKey of 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium?
The InChIKey is FGKULVBYRHKBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12NO2.Y/c1-4-10-6(2)5-8(11)7(3)9(10)12;/h4-5,11H,1-3H3;/q-1;.
What are the key properties of 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium?
1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium has a molecular weight of 255.11 g/mol, XLogP of 1.20, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-hydroxy-3,6-dimethylpyridin-2-one;yttrium is sourced from PubChem (CID 59959839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).