2-pyrimidin-2-yl-1,3-thiazolidine

C7H9N3S — CID 174902900

IUPAC2-pyrimidin-2-yl-1,3-thiazolidine
SMILESc1cnc(C2NCCS2)nc1
InChIInChI=1S/C7H9N3S/c1-2-8-6(9-3-1)7-10-4-5-11-7/h1-3,7,10H,4-5H2
InChIKeyWEMHNZVBUBQNPC-UHFFFAOYSA-N
MW167.24 g/mol
LogP0.81
Rot. Bonds1

About 2-pyrimidin-2-yl-1,3-thiazolidine

2-pyrimidin-2-yl-1,3-thiazolidine (PubChem CID 174902900) has the molecular formula C7H9N3S and a molecular weight of 167.24 g/mol. Its IUPAC name is 2-pyrimidin-2-yl-1,3-thiazolidine.

Molecular Properties

Compound Name2-pyrimidin-2-yl-1,3-thiazolidine
PubChem CID174902900
Molecular FormulaC7H9N3S
Molecular Weight167.24 g/mol
Exact Mass167.05
IUPAC Name2-pyrimidin-2-yl-1,3-thiazolidine
SMILESc1cnc(C2NCCS2)nc1
InChIInChI=1S/C7H9N3S/c1-2-8-6(9-3-1)7-10-4-5-11-7/h1-3,7,10H,4-5H2
InChIKeyWEMHNZVBUBQNPC-UHFFFAOYSA-N
XLogP0.81
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.24
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Pyrimidinemethanamine
CID 4658047
Pyrimidine-2-carbothioamide
CID 23273397
4-Pyrimidinamine, 2-(ethylthio)-
CID 565730
2-(Aminomethyl)pyrimidin-4-amine
CID 55262859
2-(Pyrrolidin-2-YL)pyrimidine
CID 18542479
1-(Pyrimidin-2-yl)methanamine hydrochloride (1:1)
CID 17848325
N-(pyrrolidin-3-yl)pyrimidin-2-amine
CID 62381001
Pyrimidin-2-ylmethanamine dihydrochloride
CID 71756671
Methyl((pyrimidin-2-yl)methyl)amine dihydrochloride
CID 118798870
2-(Pyrimidin-2-yl)ethan-1-amine
CID 20407055
N1-(2-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 62785489
2-(Allylthio)pyrimidine
CID 3680572

Frequently Asked Questions

What is the IUPAC name of 2-pyrimidin-2-yl-1,3-thiazolidine?
The IUPAC name of 2-pyrimidin-2-yl-1,3-thiazolidine (CID 174902900) is 2-pyrimidin-2-yl-1,3-thiazolidine.
What is the SMILES notation for 2-pyrimidin-2-yl-1,3-thiazolidine?
The canonical SMILES for 2-pyrimidin-2-yl-1,3-thiazolidine is c1cnc(C2NCCS2)nc1.
What is the InChIKey of 2-pyrimidin-2-yl-1,3-thiazolidine?
The InChIKey is WEMHNZVBUBQNPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3S/c1-2-8-6(9-3-1)7-10-4-5-11-7/h1-3,7,10H,4-5H2.
What are the key properties of 2-pyrimidin-2-yl-1,3-thiazolidine?
2-pyrimidin-2-yl-1,3-thiazolidine has a molecular weight of 167.24 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrimidin-2-yl-1,3-thiazolidine is sourced from PubChem (CID 174902900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).