2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile

C8H10N2O2 — CID 91416215

IUPAC2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
SMILESCC1=C(C#N)C(O)N(C)C(=O)C1
InChIInChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)8(12)6(5)4-9/h8,12H,3H2,1-2H3
InChIKeyQYMFDIPEGAEPCA-UHFFFAOYSA-N
MW166.18 g/mol
LogP0.01
Rot. Bonds

About 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile

2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile (PubChem CID 91416215) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile.

Molecular Properties

Compound Name2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
PubChem CID91416215
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
SMILESCC1=C(C#N)C(O)N(C)C(=O)C1
InChIInChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)8(12)6(5)4-9/h8,12H,3H2,1-2H3
InChIKeyQYMFDIPEGAEPCA-UHFFFAOYSA-N
XLogP0.01
TPSA64.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile 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-Butyl-2-hydroxy-4-methyl-6-oxo-2,5-dihydropyridine-5-carbonitrile
CID 24870098
1-Ethyl-2-hydroxy-4-methyl-2,5-dihydropyridin-6-one
CID 56625241
1-Ethyl-5-hydroxy-4-methyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
CID 56991785
2-Hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-5-carbonitrile
CID 57161474
1-(2-hydroxyethyl)-4-methyl-2,6-dioxo-3H-pyridine-5-carbonitrile
CID 89264552
1-(hydroxymethyl)-4-methyl-2,6-dioxo-3H-pyridine-5-carbonitrile
CID 89406663
1-[3-(Dimethylamino)propyl]-2-hydroxy-4,5-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
CID 90932462
1-(3-Hydroxypropyl)-4-methyl-6-oxo-2,5-dihydropyridine-3-carbonitrile
CID 140234146
2-hydroxy-1-(2-methoxyethyl)-4-methyl-5-methylidene-6-oxo-2H-pyridine-3-carbonitrile
CID 142226687
1-Ethyl-2-hydroxy-4-methyl-6-oxo-2,3-dihydropyridine-5-carbonitrile
CID 163449882

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile?
The IUPAC name of 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile (CID 91416215) is 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile.
What is the SMILES notation for 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile?
The canonical SMILES for 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile is CC1=C(C#N)C(O)N(C)C(=O)C1.
What is the InChIKey of 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile?
The InChIKey is QYMFDIPEGAEPCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)8(12)6(5)4-9/h8,12H,3H2,1-2H3.
What are the key properties of 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile?
2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile has a molecular weight of 166.18 g/mol, XLogP of 0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1,4-dimethyl-6-oxo-2,5-dihydropyridine-3-carbonitrile is sourced from PubChem (CID 91416215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).