1-decyl-3-hydroxy-2-methylpyridin-4-one

C16H27NO2 — CID 14956309

IUPAC1-decyl-3-hydroxy-2-methylpyridin-4-one
SMILESCCCCCCCCCCn1ccc(=O)c(O)c1C
InChIInChI=1S/C16H27NO2/c1-3-4-5-6-7-8-9-10-12-17-13-11-15(18)16(19)14(17)2/h11,13,19H,3-10,12H2,1-2H3
InChIKeyIFVJFFVXPHNLLQ-UHFFFAOYSA-N
MW265.40 g/mol
LogP4.00
Rot. Bonds9

About 1-decyl-3-hydroxy-2-methylpyridin-4-one

1-decyl-3-hydroxy-2-methylpyridin-4-one (PubChem CID 14956309) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 1-decyl-3-hydroxy-2-methylpyridin-4-one.

Molecular Properties

Compound Name1-decyl-3-hydroxy-2-methylpyridin-4-one
PubChem CID14956309
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name1-decyl-3-hydroxy-2-methylpyridin-4-one
SMILESCCCCCCCCCCn1ccc(=O)c(O)c1C
InChIInChI=1S/C16H27NO2/c1-3-4-5-6-7-8-9-10-12-17-13-11-15(18)16(19)14(17)2/h11,13,19H,3-10,12H2,1-2H3
InChIKeyIFVJFFVXPHNLLQ-UHFFFAOYSA-N
XLogP4.00
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-hydroxy-1-[8-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)octyl]-2-methylpyridin-4-one
CID 19821577
tris(1-butyl-3-hydroxy-2-methylpyridin-4-one);iron
CID 10531560
3-hydroxy-2-methyl-1-propylpyridin-4-one;iron;hydrochloride
CID 67948190
1-(3-aminopropyl)-3-hydroxy-2-methylpyridin-4-one
CID 11600788
1-[4-(dimethylamino)butyl]-3-hydroxy-2-methylpyridin-4-one
CID 82212099
4-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-methylbutanamide
CID 10609176
2-amino-6-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)hexanoic acid
CID 25205018
1-(5-amino-7-hydroxy-6-oxoheptyl)-3-hydroxy-2-methylpyridin-4-one
CID 91098436
bis(1-ethyl-3-hydroxy-2-methylpyridin-4-one);oxovanadium
CID 10883182
N-ethyl-3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propanamide
CID 14956315
8-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)-N-[2-[2-[8-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)octanoylamino]ethoxy]ethyl]octanamide
CID 101236639
3-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)propyl 4-methylbenzoate
CID 10266853

Frequently Asked Questions

What is the IUPAC name of 1-decyl-3-hydroxy-2-methylpyridin-4-one?
The IUPAC name of 1-decyl-3-hydroxy-2-methylpyridin-4-one (CID 14956309) is 1-decyl-3-hydroxy-2-methylpyridin-4-one.
What is the SMILES notation for 1-decyl-3-hydroxy-2-methylpyridin-4-one?
The canonical SMILES for 1-decyl-3-hydroxy-2-methylpyridin-4-one is CCCCCCCCCCn1ccc(=O)c(O)c1C.
What is the InChIKey of 1-decyl-3-hydroxy-2-methylpyridin-4-one?
The InChIKey is IFVJFFVXPHNLLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-3-4-5-6-7-8-9-10-12-17-13-11-15(18)16(19)14(17)2/h11,13,19H,3-10,12H2,1-2H3.
What are the key properties of 1-decyl-3-hydroxy-2-methylpyridin-4-one?
1-decyl-3-hydroxy-2-methylpyridin-4-one has a molecular weight of 265.40 g/mol, XLogP of 4.00, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decyl-3-hydroxy-2-methylpyridin-4-one is sourced from PubChem (CID 14956309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).