2-ethyl-2-propan-2-yl-1,3-thiazolidine

C8H17NS — CID 45096103

IUPAC2-ethyl-2-propan-2-yl-1,3-thiazolidine
SMILESCCC1(C(C)C)NCCS1
InChIInChI=1S/C8H17NS/c1-4-8(7(2)3)9-5-6-10-8/h7,9H,4-6H2,1-3H3
InChIKeyCHLYBDIGWAKMCJ-UHFFFAOYSA-N
MW159.30 g/mol
LogP2.09
Rot. Bonds2

About 2-ethyl-2-propan-2-yl-1,3-thiazolidine

2-ethyl-2-propan-2-yl-1,3-thiazolidine (PubChem CID 45096103) has the molecular formula C8H17NS and a molecular weight of 159.30 g/mol. Its IUPAC name is 2-ethyl-2-propan-2-yl-1,3-thiazolidine.

Molecular Properties

Compound Name2-ethyl-2-propan-2-yl-1,3-thiazolidine
PubChem CID45096103
Molecular FormulaC8H17NS
Molecular Weight159.30 g/mol
Exact Mass159.11
IUPAC Name2-ethyl-2-propan-2-yl-1,3-thiazolidine
SMILESCCC1(C(C)C)NCCS1
InChIInChI=1S/C8H17NS/c1-4-8(7(2)3)9-5-6-10-8/h7,9H,4-6H2,1-3H3
InChIKeyCHLYBDIGWAKMCJ-UHFFFAOYSA-N
XLogP2.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.30
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Isopropylthiazolidine
CID 146886
2-Isobutylthiazolidine
CID 135445
2-Butyl-2-methyl-1,3-thiazolidine
CID 120766
2-(Pentan-2-yl)-1,3-thiazolidine
CID 218555
2,2-Diethylthiazolidine
CID 69837
Thiazolidine, 2,2-dipropyl-
CID 204659
5,5-Dimethyl-2-isopropylthiazolidine
CID 15751859
2-Methyl-2-(3-methylbutyl)-1,3-thiazolidine
CID 3058780
Thiazolidine, 5-methyl-2-(1-methylethyl)-
CID 3087735
2-(1-Methylpropyl)thiazolidine
CID 525967
2-Methyl-2-isopropylthiazolidin
CID 21449915
2-Methyl-4-propan-2-yl-5-(trifluoromethyl)-1,3-thiazolidine
CID 140796110

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-propan-2-yl-1,3-thiazolidine?
The IUPAC name of 2-ethyl-2-propan-2-yl-1,3-thiazolidine (CID 45096103) is 2-ethyl-2-propan-2-yl-1,3-thiazolidine.
What is the SMILES notation for 2-ethyl-2-propan-2-yl-1,3-thiazolidine?
The canonical SMILES for 2-ethyl-2-propan-2-yl-1,3-thiazolidine is CCC1(C(C)C)NCCS1.
What is the InChIKey of 2-ethyl-2-propan-2-yl-1,3-thiazolidine?
The InChIKey is CHLYBDIGWAKMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NS/c1-4-8(7(2)3)9-5-6-10-8/h7,9H,4-6H2,1-3H3.
What are the key properties of 2-ethyl-2-propan-2-yl-1,3-thiazolidine?
2-ethyl-2-propan-2-yl-1,3-thiazolidine has a molecular weight of 159.30 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-propan-2-yl-1,3-thiazolidine is sourced from PubChem (CID 45096103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).