N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine

C15H28N2S — CID 135977294

IUPACN-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine
SMILESCCC1(CC)CS/C(=N\CCC2CCCCC2)N1
InChIInChI=1S/C15H28N2S/c1-3-15(4-2)12-18-14(17-15)16-11-10-13-8-6-5-7-9-13/h13H,3-12H2,1-2H3,(H,16,17)
InChIKeyIOMOBXWYGVZHGS-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.21
Rot. Bonds5

About N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine

N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine (PubChem CID 135977294) has the molecular formula C15H28N2S and a molecular weight of 268.47 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine
PubChem CID135977294
Molecular FormulaC15H28N2S
Molecular Weight268.47 g/mol
Exact Mass268.20
IUPAC NameN-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine
SMILESCCC1(CC)CS/C(=N\CCC2CCCCC2)N1
InChIInChI=1S/C15H28N2S/c1-3-15(4-2)12-18-14(17-15)16-11-10-13-8-6-5-7-9-13/h13H,3-12H2,1-2H3,(H,16,17)
InChIKeyIOMOBXWYGVZHGS-UHFFFAOYSA-N
XLogP4.21
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-cyclopentylpropyl)-4,4-diethyl-1,3-thiazolidin-2-imine
CID 137000525
N-[(1-cyclopropylcyclopropyl)methyl]-4,4-diethyl-1,3-thiazolidin-2-imine
CID 136870697
4,4-diethyl-N-[(1-ethylpyrrolidin-3-yl)methyl]-1,3-thiazolidin-2-imine
CID 135977043
N-[(1,1-dioxothiolan-3-yl)methyl]-4,4-diethyl-1,3-thiazolidin-2-imine
CID 135977171
4,4-diethyl-N-[(1-methylsulfanylcyclohexyl)methyl]-1,3-thiazolidin-2-imine
CID 136762681
5-[[(4,4-diethyl-1,3-thiazolidin-2-ylidene)amino]methyl]pyrrolidin-2-one
CID 135978278
N-(2-cyclohexylethyl)-4-propan-2-yl-1,3-thiazinan-2-imine
CID 136848107
N-(2-ethoxy-2-methylpropyl)-4,4-diethyl-1,3-thiazolidin-2-imine
CID 136954513
4,4-diethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-1,3-thiazolidin-2-imine
CID 136908728
4,4-diethyl-N-[3-(triazol-1-yl)propyl]-1,3-thiazolidin-2-imine
CID 136824830
7-methyl-N-[2-(oxolan-3-yl)ethyl]-3-thia-1-azaspiro[4.5]decan-2-imine
CID 136857917
2-[(4,4-diethyl-1,3-thiazolidin-2-ylidene)amino]-N,N-diethylacetamide
CID 136748295

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine?
The IUPAC name of N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine (CID 135977294) is N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine.
What is the SMILES notation for N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine?
The canonical SMILES for N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine is CCC1(CC)CS/C(=N\CCC2CCCCC2)N1.
What is the InChIKey of N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine?
The InChIKey is IOMOBXWYGVZHGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2S/c1-3-15(4-2)12-18-14(17-15)16-11-10-13-8-6-5-7-9-13/h13H,3-12H2,1-2H3,(H,16,17).
What are the key properties of N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine?
N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine has a molecular weight of 268.47 g/mol, XLogP of 4.21, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-4,4-diethyl-1,3-thiazolidin-2-imine is sourced from PubChem (CID 135977294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).