6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one

C11H18N2O2 — CID 59712725

IUPAC6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one
SMILESCNCCCn1c(O)c(C)c(C)cc1=O
InChIInChI=1S/C11H18N2O2/c1-8-7-10(14)13(6-4-5-12-3)11(15)9(8)2/h7,12,15H,4-6H2,1-3H3
InChIKeyWZHWHRHLBVOMMR-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.78
Rot. Bonds4

About 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one

6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one (PubChem CID 59712725) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one.

Molecular Properties

Compound Name6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one
PubChem CID59712725
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one
SMILESCNCCCn1c(O)c(C)c(C)cc1=O
InChIInChI=1S/C11H18N2O2/c1-8-7-10(14)13(6-4-5-12-3)11(15)9(8)2/h7,12,15H,4-6H2,1-3H3
InChIKeyWZHWHRHLBVOMMR-UHFFFAOYSA-N
XLogP0.78
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(dimethylamino)propyl]-6-hydroxy-4-methyl-3H-pyridin-2-one
CID 53848115
Neonicotinoid_TP181a
CID 177923733
5-(diethylaminomethyl)-1H-pyridin-2-one
CID 9812925
2(1H)-Pyridinone, 6-hydroxy-4-methyl-1-[3-(methylamino)propyl]-
CID 11275604
2-Hydroxy-4-methyl-1-(2-methylpropyl)-6-oxopyridine-3-carboxamide
CID 15131400
2-Hydroxy-4-methyl-6-oxo-1-propylpyridine-3-carboxamide
CID 15216538
1-Butyl-2-hydroxy-4-methyl-6-oxopyridine-3-carboxamide
CID 15216539
N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]propanamide
CID 16342672
N-(1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)formamide
CID 19734878
N-[(1-ethyl-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)methyl]acetamide
CID 20518071
1-Ethyl-6-hydroxy-4,5-dimethylpyridin-2-one
CID 20518092
1-(3-Aminopropyl)-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile
CID 20541680

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one?
The IUPAC name of 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one (CID 59712725) is 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one.
What is the SMILES notation for 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one?
The canonical SMILES for 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one is CNCCCn1c(O)c(C)c(C)cc1=O.
What is the InChIKey of 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one?
The InChIKey is WZHWHRHLBVOMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-8-7-10(14)13(6-4-5-12-3)11(15)9(8)2/h7,12,15H,4-6H2,1-3H3.
What are the key properties of 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one?
6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one has a molecular weight of 210.28 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-4,5-dimethyl-1-[3-(methylamino)propyl]pyridin-2-one is sourced from PubChem (CID 59712725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).