2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

C19H24N2OS — CID 16728779

IUPAC2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2C23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C19H24N2OS/c1-12-3-2-4-16(20-12)21-17(22)11-23-18(21)19-8-13-5-14(9-19)7-15(6-13)10-19/h2-4,13-15,18H,5-11H2,1H3
InChIKeyWALLGOIBLNJRNB-UHFFFAOYSA-N
MW328.48 g/mol
LogP4.01
Rot. Bonds2

About 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one

2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (PubChem CID 16728779) has the molecular formula C19H24N2OS and a molecular weight of 328.48 g/mol. Its IUPAC name is 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
PubChem CID16728779
Molecular FormulaC19H24N2OS
Molecular Weight328.48 g/mol
Exact Mass328.16
IUPAC Name2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2C23CC4CC(CC(C4)C2)C3)n1
InChIInChI=1S/C19H24N2OS/c1-12-3-2-4-16(20-12)21-17(22)11-23-18(21)19-8-13-5-14(9-19)7-15(6-13)10-19/h2-4,13-15,18H,5-11H2,1H3
InChIKeyWALLGOIBLNJRNB-UHFFFAOYSA-N
XLogP4.01
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.48
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-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

2-(3,5-dichloro-4-pyridinyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 57390348
2-(2-fluoro-6-methoxyphenyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 513677
5-(1-adamantyl)-2-(6-methyl-2-pyridinyl)isoindole-1,3-dione
CID 4536341
2-(2,6-dimethylphenyl)-3-(4,6-dimethyl-2-pyridinyl)-1,3-thiazolidin-4-one
CID 513686
2-(6-methyl-2-pyridinyl)-1-oxo-2-azaspiro[4.5]decane-3-carboxamide
CID 173465864
(1R,7S)-4-(6-methyl-2-pyridinyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 91653706
(1R,2S,6R,7R)-4-(6-methyl-2-pyridinyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 23309765
4-chloro-1-(6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 168688343
ethane;1-(6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 142348344
8-(6-methyl-2-pyridinyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61235208
(1R,2S,6R,7R,8S,9S)-8,9-dibromo-4-(6-methyl-2-pyridinyl)-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
CID 124718293
2-(3,3-dimethylazetidin-1-yl)-6-methylpyridine
CID 142297268

Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The IUPAC name of 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one (CID 16728779) is 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is Cc1cccc(N2C(=O)CSC2C23CC4CC(CC(C4)C2)C3)n1.
What is the InChIKey of 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
The InChIKey is WALLGOIBLNJRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2OS/c1-12-3-2-4-16(20-12)21-17(22)11-23-18(21)19-8-13-5-14(9-19)7-15(6-13)10-19/h2-4,13-15,18H,5-11H2,1H3.
What are the key properties of 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one?
2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one has a molecular weight of 328.48 g/mol, XLogP of 4.01, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-3-(6-methyl-2-pyridinyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 16728779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).