6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one

C12H14N2O2 — CID 106316330

IUPAC6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one
SMILESCC1=CCCN(C(=O)c2cccc(=O)[nH]2)C1
InChIInChI=1S/C12H14N2O2/c1-9-4-3-7-14(8-9)12(16)10-5-2-6-11(15)13-10/h2,4-6H,3,7-8H2,1H3,(H,13,15)
InChIKeyLQJJQTPBTQIETP-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.17
Rot. Bonds1

About 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one

6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 106316330) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one
PubChem CID106316330
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one
SMILESCC1=CCCN(C(=O)c2cccc(=O)[nH]2)C1
InChIInChI=1S/C12H14N2O2/c1-9-4-3-7-14(8-9)12(16)10-5-2-6-11(15)13-10/h2,4-6H,3,7-8H2,1H3,(H,13,15)
InChIKeyLQJJQTPBTQIETP-UHFFFAOYSA-N
XLogP1.17
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-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

6-(morpholine-4-carbonyl)-1H-pyridin-2-one
CID 107261416
6-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 107261752
6-(2-methyl-2,8-diazaspiro[4.5]decane-8-carbonyl)-1H-pyridin-2-one
CID 50951821
6-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-1H-pyridin-2-one
CID 107261574
6-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 107262059
6-(2,6-dimethylthiomorpholine-4-carbonyl)-1H-pyridin-2-one
CID 114040378
6-(3-ethyl-4-oxopiperidine-1-carbonyl)-1H-pyridin-2-one
CID 114040137
3-methyl-1-(6-oxo-1H-pyridine-2-carbonyl)pyrrolidine-3-carboxylic acid
CID 114040074
3-methyl-1-(6-oxo-1H-pyridine-2-carbonyl)pyrrolidine-3-carboxamide
CID 114082421
6-(2-ethylmorpholine-4-carbonyl)-1H-pyridin-2-one
CID 107261637
2-[1-(6-oxo-1H-pyridine-2-carbonyl)piperidin-4-yl]acetamide
CID 107261816
5-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)furan-2-carboxylic acid
CID 106316251

Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one (CID 106316330) is 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one is CC1=CCCN(C(=O)c2cccc(=O)[nH]2)C1.
What is the InChIKey of 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is LQJJQTPBTQIETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-9-4-3-7-14(8-9)12(16)10-5-2-6-11(15)13-10/h2,4-6H,3,7-8H2,1H3,(H,13,15).
What are the key properties of 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one?
6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 218.26 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 106316330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).