6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane

C14H23NO2 — CID 145081147

IUPAC6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane
SMILESCC.Cc1cc(C2CCCCC2)n(O)c(=O)c1
InChIInChI=1S/C12H17NO2.C2H6/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10;1-2/h7-8,10,15H,2-6H2,1H3;1-2H3
InChIKeyZYSVUVVTZQUAEO-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.47
Rot. Bonds1

About 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane

6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane (PubChem CID 145081147) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane.

Molecular Properties

Compound Name6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane
PubChem CID145081147
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane
SMILESCC.Cc1cc(C2CCCCC2)n(O)c(=O)c1
InChIInChI=1S/C12H17NO2.C2H6/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10;1-2/h7-8,10,15H,2-6H2,1H3;1-2H3
InChIKeyZYSVUVVTZQUAEO-UHFFFAOYSA-N
XLogP3.47
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Ciclopirox
CID 2749
Piroctone
CID 50259
6-Cyclohexyl-1-hydroxypyridin-2-one
CID 25069320
Fosciclopirox
CID 67773619
6-Cycloheptyl-1-hydroxy-4-methylpyridin-2-one
CID 155523702
6-(Cyclohexylmethyl)-1-hydroxy-4-methylpyridin-2-one
CID 21520138
6-Cyclopentyl-1-hydroxy-4-methylpyridin-2-one
CID 13590962
6-Cyclobutyl-1-hydroxy-4-methylpyridin-2-one
CID 155516672
1-Hydroxy-4-methyl-6-nonylpyridin-2-one
CID 13590948
6-Heptyl-1-hydroxy-4-methylpyridin-2-one
CID 20158105
3-Bromo-6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one
CID 139553634
6-Cyclohexyl-1-hydroxy-3-iodo-4-methylpyridin-2-one
CID 139553636

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane?
The IUPAC name of 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane (CID 145081147) is 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane.
What is the SMILES notation for 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane?
The canonical SMILES for 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane is CC.Cc1cc(C2CCCCC2)n(O)c(=O)c1.
What is the InChIKey of 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane?
The InChIKey is ZYSVUVVTZQUAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2.C2H6/c1-9-7-11(13(15)12(14)8-9)10-5-3-2-4-6-10;1-2/h7-8,10,15H,2-6H2,1H3;1-2H3.
What are the key properties of 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane?
6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane has a molecular weight of 237.34 g/mol, XLogP of 3.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-1-hydroxy-4-methylpyridin-2-one;ethane is sourced from PubChem (CID 145081147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).