N,5-dimethyl-1,3-thiazolidin-2-imine

C5H10N2S — CID 135403375

IUPACN,5-dimethyl-1,3-thiazolidin-2-imine
SMILESC/N=C1/NCC(C)S1
InChIInChI=1S/C5H10N2S/c1-4-3-7-5(6-2)8-4/h4H,3H2,1-2H3,(H,6,7)
InChIKeyRMUKYRGITOHRGW-UHFFFAOYSA-N
MW130.22 g/mol
LogP0.70
Rot. Bonds

About N,5-dimethyl-1,3-thiazolidin-2-imine

N,5-dimethyl-1,3-thiazolidin-2-imine (PubChem CID 135403375) has the molecular formula C5H10N2S and a molecular weight of 130.22 g/mol. Its IUPAC name is N,5-dimethyl-1,3-thiazolidin-2-imine.

Molecular Properties

Compound NameN,5-dimethyl-1,3-thiazolidin-2-imine
PubChem CID135403375
Molecular FormulaC5H10N2S
Molecular Weight130.22 g/mol
Exact Mass130.06
IUPAC NameN,5-dimethyl-1,3-thiazolidin-2-imine
SMILESC/N=C1/NCC(C)S1
InChIInChI=1S/C5H10N2S/c1-4-3-7-5(6-2)8-4/h4H,3H2,1-2H3,(H,6,7)
InChIKeyRMUKYRGITOHRGW-UHFFFAOYSA-N
XLogP0.70
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.22
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-1,3-thiazolidin-2-imine?
The IUPAC name of N,5-dimethyl-1,3-thiazolidin-2-imine (CID 135403375) is N,5-dimethyl-1,3-thiazolidin-2-imine.
What is the SMILES notation for N,5-dimethyl-1,3-thiazolidin-2-imine?
The canonical SMILES for N,5-dimethyl-1,3-thiazolidin-2-imine is C/N=C1/NCC(C)S1.
What is the InChIKey of N,5-dimethyl-1,3-thiazolidin-2-imine?
The InChIKey is RMUKYRGITOHRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2S/c1-4-3-7-5(6-2)8-4/h4H,3H2,1-2H3,(H,6,7).
What are the key properties of N,5-dimethyl-1,3-thiazolidin-2-imine?
N,5-dimethyl-1,3-thiazolidin-2-imine has a molecular weight of 130.22 g/mol, XLogP of 0.70, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-1,3-thiazolidin-2-imine is sourced from PubChem (CID 135403375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).