(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone

C19H20N2O — CID 125142867

IUPAC(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1cccc(C(=O)N2CCC=C(c3ccncc3)C2)c1C
InChIInChI=1S/C19H20N2O/c1-14-5-3-7-18(15(14)2)19(22)21-12-4-6-17(13-21)16-8-10-20-11-9-16/h3,5-11H,4,12-13H2,1-2H3
InChIKeyZBFXJJSJLZOCFW-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.63
Rot. Bonds2

About (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone

(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 125142867) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID125142867
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1cccc(C(=O)N2CCC=C(c3ccncc3)C2)c1C
InChIInChI=1S/C19H20N2O/c1-14-5-3-7-18(15(14)2)19(22)21-12-4-6-17(13-21)16-8-10-20-11-9-16/h3,5-11H,4,12-13H2,1-2H3
InChIKeyZBFXJJSJLZOCFW-UHFFFAOYSA-N
XLogP3.63
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone 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

(5-methyl-1-pentan-3-ylpyrazol-4-yl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 122134961
(2,3-dimethylphenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
CID 35856697
3-[5-(3-hydroxyphenyl)-3,6-dihydro-2H-pyridine-1-carbonyl]-4-methylbenzoic acid
CID 166398016
[5-(5-phenyl-3,6-dihydro-2H-pyridine-1-carbonyl)-3-pyridinyl]-(5-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
CID 154837601
[4-(dimethylamino)-2-pyridin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl]-(2-hydroxy-3-methylphenyl)methanone
CID 56882815
(2,3-dimethylphenyl)-(4-pyrazin-2-ylpiperazin-1-yl)methanone
CID 42023215
(2,3-dimethylphenyl)-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119560822
(2,3-dimethylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 78783803
(3-hydroxyazetidin-1-yl)-(3-hydroxy-2-methylphenyl)methanone
CID 82829609
(3-chloro-4-pyridinyl)-(2,3-dimethylphenyl)methanone
CID 105093856
(7-hydroxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-hydroxy-2-methylphenyl)methanone
CID 82809173
2,3-dimethyl-N-pyridin-4-ylbenzamide
CID 27700072

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone (CID 125142867) is (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone is Cc1cccc(C(=O)N2CCC=C(c3ccncc3)C2)c1C.
What is the InChIKey of (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is ZBFXJJSJLZOCFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-14-5-3-7-18(15(14)2)19(22)21-12-4-6-17(13-21)16-8-10-20-11-9-16/h3,5-11H,4,12-13H2,1-2H3.
What are the key properties of (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone?
(2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 292.38 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-(5-pyridin-4-yl-3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 125142867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).