2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine

C10H17N3S — CID 83091978

IUPAC2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine
SMILESCCC1CSC(c2cn(C)nc2C)N1
InChIInChI=1S/C10H17N3S/c1-4-8-6-14-10(11-8)9-5-13(3)12-7(9)2/h5,8,10-11H,4,6H2,1-3H3
InChIKeyJTNUCKLSUOZBNL-UHFFFAOYSA-N
MW211.33 g/mol
LogP1.84
Rot. Bonds2

About 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine

2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine (PubChem CID 83091978) has the molecular formula C10H17N3S and a molecular weight of 211.33 g/mol. Its IUPAC name is 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine.

Molecular Properties

Compound Name2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine
PubChem CID83091978
Molecular FormulaC10H17N3S
Molecular Weight211.33 g/mol
Exact Mass211.11
IUPAC Name2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine
SMILESCCC1CSC(c2cn(C)nc2C)N1
InChIInChI=1S/C10H17N3S/c1-4-8-6-14-10(11-8)9-5-13(3)12-7(9)2/h5,8,10-11H,4,6H2,1-3H3
InChIKeyJTNUCKLSUOZBNL-UHFFFAOYSA-N
XLogP1.84
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine?
The IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine (CID 83091978) is 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine.
What is the SMILES notation for 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine?
The canonical SMILES for 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine is CCC1CSC(c2cn(C)nc2C)N1.
What is the InChIKey of 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine?
The InChIKey is JTNUCKLSUOZBNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S/c1-4-8-6-14-10(11-8)9-5-13(3)12-7(9)2/h5,8,10-11H,4,6H2,1-3H3.
What are the key properties of 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine?
2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine has a molecular weight of 211.33 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dimethylpyrazol-4-yl)-4-ethyl-1,3-thiazolidine is sourced from PubChem (CID 83091978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).