2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole

C12H21N3S — CID 54560328

IUPAC2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole
SMILESCCC1(c2nccs2)NC(C)(C)C(C)(C)N1
InChIInChI=1S/C12H21N3S/c1-6-12(9-13-7-8-16-9)14-10(2,3)11(4,5)15-12/h7-8,14-15H,6H2,1-5H3
InChIKeyZQCCWXSHZUQMLY-UHFFFAOYSA-N
MW239.39 g/mol
LogP2.46
Rot. Bonds2

About 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole

2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole (PubChem CID 54560328) has the molecular formula C12H21N3S and a molecular weight of 239.39 g/mol. Its IUPAC name is 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole.

Molecular Properties

Compound Name2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole
PubChem CID54560328
Molecular FormulaC12H21N3S
Molecular Weight239.39 g/mol
Exact Mass239.15
IUPAC Name2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole
SMILESCCC1(c2nccs2)NC(C)(C)C(C)(C)N1
InChIInChI=1S/C12H21N3S/c1-6-12(9-13-7-8-16-9)14-10(2,3)11(4,5)15-12/h7-8,14-15H,6H2,1-5H3
InChIKeyZQCCWXSHZUQMLY-UHFFFAOYSA-N
XLogP2.46
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,3-Thiazol-2-yl)butan-2-amine
CID 53534946
2-(1,3-Thiazol-2-yl)propan-2-amine
CID 28286203
1-pentyl-3-[(2S)-2-(1,3-thiazol-2-yl)butan-2-yl]urea
CID 97215596
4,4,5,5-Tetramethyl-2-(1,3-thiazol-2-yl)imidazolidine-1,3-diol
CID 71405753
2-(2-Methyl-1,3-thiazolidin-2-yl)-1,3-thiazole
CID 90746535
1-(1,3-thiazol-2-yl)-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]ethanamine
CID 64993541
N-(2-fluoroethyl)-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103760807
N-(3-fluoropropyl)-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103790341
N-[2-fluoro-3-(1,3-thiazol-2-yl)propyl]-2-methylpropan-2-amine
CID 107446506
N-propan-2-yl-1-(1,3-thiazol-2-yl)propan-1-amine
CID 16495143
2-(2-Ethyl-4,4,5,5-tetramethyl-1,3-diazinan-2-yl)-1,3-thiazole
CID 54087146
1-N,1-N',1-N"-triethyl-4-(1,3-thiazol-2-yl)butane-1,1,1-triamine
CID 54180555

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole?
The IUPAC name of 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole (CID 54560328) is 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole.
What is the SMILES notation for 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole?
The canonical SMILES for 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole is CCC1(c2nccs2)NC(C)(C)C(C)(C)N1.
What is the InChIKey of 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole?
The InChIKey is ZQCCWXSHZUQMLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3S/c1-6-12(9-13-7-8-16-9)14-10(2,3)11(4,5)15-12/h7-8,14-15H,6H2,1-5H3.
What are the key properties of 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole?
2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole has a molecular weight of 239.39 g/mol, XLogP of 2.46, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-4,4,5,5-tetramethylimidazolidin-2-yl)-1,3-thiazole is sourced from PubChem (CID 54560328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).