4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine

C11H23NS — CID 126978863

IUPAC4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine
SMILESCCC1CSC(C(C)C)(C(C)C)N1
InChIInChI=1S/C11H23NS/c1-6-10-7-13-11(12-10,8(2)3)9(4)5/h8-10,12H,6-7H2,1-5H3
InChIKeyIWWLSLKLZULTGY-UHFFFAOYSA-N
MW201.38 g/mol
LogP3.11
Rot. Bonds3

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

4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine (PubChem CID 126978863) has the molecular formula C11H23NS and a molecular weight of 201.38 g/mol. Its IUPAC name is 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine.

Molecular Properties

Compound Name4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine
PubChem CID126978863
Molecular FormulaC11H23NS
Molecular Weight201.38 g/mol
Exact Mass201.16
IUPAC Name4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine
SMILESCCC1CSC(C(C)C)(C(C)C)N1
InChIInChI=1S/C11H23NS/c1-6-10-7-13-11(12-10,8(2)3)9(4)5/h8-10,12H,6-7H2,1-5H3
InChIKeyIWWLSLKLZULTGY-UHFFFAOYSA-N
XLogP3.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-ethyl-3,3-dimethyl-5-thia-8-azaspiro[3.4]octane
CID 130555258
7-ethyl-2,3-dimethyl-5-thia-8-azaspiro[3.4]octane
CID 130709676
3-ethyl-7-propan-2-yl-8-oxa-1-thia-4-azaspiro[4.5]decane
CID 80500654
3-ethyl-9,9-dimethyl-1-thia-4-azaspiro[4.4]nonane
CID 80500491
3-ethyl-1-thia-4,9-diazaspiro[4.5]decane
CID 80500848
3-ethyl-6-methyl-7-oxa-1-thia-4-azaspiro[4.4]nonane
CID 82717464
3-ethyl-7,7-dimethyl-1-thia-4,8-diazaspiro[4.5]decane
CID 164646753
4-ethyl-2-methyl-2-propan-2-yl-1,3-oxazolidine
CID 45096021
4-ethyl-2-(2-methylpropyl)-1,3-thiazolidine
CID 66230749
2-(4-bromo-2-fluorophenyl)-4-ethyl-2-methyl-1,3-thiazolidine
CID 82972720
4'-ethyl-7-fluorospiro[1,2-dihydroindene-3,2'-1,3-thiazolidine]
CID 83069817
3-ethyl-8-(2-phenylethyl)-1-thia-4,8-diazaspiro[4.5]decane
CID 80500818

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine?
The IUPAC name of 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine (CID 126978863) is 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine.
What is the SMILES notation for 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine?
The canonical SMILES for 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine is CCC1CSC(C(C)C)(C(C)C)N1.
What is the InChIKey of 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine?
The InChIKey is IWWLSLKLZULTGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NS/c1-6-10-7-13-11(12-10,8(2)3)9(4)5/h8-10,12H,6-7H2,1-5H3.
What are the key properties of 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine?
4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine has a molecular weight of 201.38 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,2-di(propan-2-yl)-1,3-thiazolidine is sourced from PubChem (CID 126978863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).