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

C14H13N3OS — CID 54578706

IUPAC3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2ccccn2)n1
InChIInChI=1S/C14H13N3OS/c1-10-5-4-7-12(16-10)17-13(18)9-19-14(17)11-6-2-3-8-15-11/h2-8,14H,9H2,1H3
InChIKeyROCLKIQUIFRZTB-UHFFFAOYSA-N
MW271.35 g/mol
LogP2.56
Rot. Bonds2

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

3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one (PubChem CID 54578706) has the molecular formula C14H13N3OS and a molecular weight of 271.35 g/mol. Its IUPAC name is 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
PubChem CID54578706
Molecular FormulaC14H13N3OS
Molecular Weight271.35 g/mol
Exact Mass271.08
IUPAC Name3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
SMILESCc1cccc(N2C(=O)CSC2c2ccccn2)n1
InChIInChI=1S/C14H13N3OS/c1-10-5-4-7-12(16-10)17-13(18)9-19-14(17)11-6-2-3-8-15-11/h2-8,14H,9H2,1H3
InChIKeyROCLKIQUIFRZTB-UHFFFAOYSA-N
XLogP2.56
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.35
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-Thiazolidinone, 2-(2,6-difluorophenyl)-3-(2-pyridinyl)-
CID 486675
4-Thiazolidinone, 2-(2,6-difluorophenyl)-3-(4-methyl-2-pyridinyl)-
CID 486681
3-Phenyl-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 3237434
N,N-2,2'-Dipyridylacetamide
CID 52053
3-(2-(4-(2-Pyridyl)piperazin-1-yl)acetyl)thiazolidine (3b)
CID 91937922
1-[4-(Pyridin-2-yl)piperazin-1-yl]ethan-1-one
CID 572286
1-(4-(2-Pyridyl)piperazinyl)-2-(2-thienyl)ethan-1-one
CID 762642
4-Methyl-2-pyrimidinyl 2-oxo-2-(4-phenyl-1-piperazinyl)ethyl sulfide
CID 851620
2-{5-[(Phenylthio)methyl]-1,2,4-oxadiazol-3-yl}pyridine
CID 2195556
3-(Imidazo[1,2-a]pyridin-2-ylmethyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one
CID 2997740
N-pyridin-2-yl-2-[(2-pyridin-2-ylethyl)thio]acetamide
CID 3238824
N-(5-bromopyridin-2-yl)-2-(2-pyridin-2-ylethylsulfanyl)acetamide
CID 3275372

Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one?
The IUPAC name of 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one (CID 54578706) is 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one is Cc1cccc(N2C(=O)CSC2c2ccccn2)n1.
What is the InChIKey of 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one?
The InChIKey is ROCLKIQUIFRZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS/c1-10-5-4-7-12(16-10)17-13(18)9-19-14(17)11-6-2-3-8-15-11/h2-8,14H,9H2,1H3.
What are the key properties of 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one?
3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one has a molecular weight of 271.35 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-2-pyridinyl)-2-pyridin-2-yl-1,3-thiazolidin-4-one is sourced from PubChem (CID 54578706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).