4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one

C8H13NO2 — CID 54705604

IUPAC4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one
SMILESCCCC1CC(O)=CC(=O)N1
InChIInChI=1S/C8H13NO2/c1-2-3-6-4-7(10)5-8(11)9-6/h5-6,10H,2-4H2,1H3,(H,9,11)
InChIKeyXVWBWDKYPHYOOO-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.12
Rot. Bonds2

About 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one

4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one (PubChem CID 54705604) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one.

Molecular Properties

Compound Name4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one
PubChem CID54705604
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one
SMILESCCCC1CC(O)=CC(=O)N1
InChIInChI=1S/C8H13NO2/c1-2-3-6-4-7(10)5-8(11)9-6/h5-6,10H,2-4H2,1H3,(H,9,11)
InChIKeyXVWBWDKYPHYOOO-UHFFFAOYSA-N
XLogP1.12
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one?
The IUPAC name of 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one (CID 54705604) is 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one.
What is the SMILES notation for 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one?
The canonical SMILES for 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one is CCCC1CC(O)=CC(=O)N1.
What is the InChIKey of 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one?
The InChIKey is XVWBWDKYPHYOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-3-6-4-7(10)5-8(11)9-6/h5-6,10H,2-4H2,1H3,(H,9,11).
What are the key properties of 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one?
4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one has a molecular weight of 155.20 g/mol, XLogP of 1.12, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-propyl-2,3-dihydro-1H-pyridin-6-one is sourced from PubChem (CID 54705604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).