6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one

C9H14N2O2 — CID 20562287

IUPAC6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one
SMILESCNCCn1c(O)cc(C)cc1=O
InChIInChI=1S/C9H14N2O2/c1-7-5-8(12)11(4-3-10-2)9(13)6-7/h5-6,10,12H,3-4H2,1-2H3
InChIKeyYNBIUJSXOAVNKD-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.08
Rot. Bonds3

About 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one

6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one (PubChem CID 20562287) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one.

Molecular Properties

Compound Name6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one
PubChem CID20562287
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one
SMILESCNCCn1c(O)cc(C)cc1=O
InChIInChI=1S/C9H14N2O2/c1-7-5-8(12)11(4-3-10-2)9(13)6-7/h5-6,10,12H,3-4H2,1-2H3
InChIKeyYNBIUJSXOAVNKD-UHFFFAOYSA-N
XLogP0.08
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one?
The IUPAC name of 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one (CID 20562287) is 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one.
What is the SMILES notation for 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one?
The canonical SMILES for 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one is CNCCn1c(O)cc(C)cc1=O.
What is the InChIKey of 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one?
The InChIKey is YNBIUJSXOAVNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-7-5-8(12)11(4-3-10-2)9(13)6-7/h5-6,10,12H,3-4H2,1-2H3.
What are the key properties of 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one?
6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one has a molecular weight of 182.22 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-4-methyl-1-[2-(methylamino)ethyl]pyridin-2-one is sourced from PubChem (CID 20562287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).