2-ethyl-1-imino-1,2-thiazolidine 1-oxide

C5H12N2OS — CID 134485221

IUPAC2-ethyl-1-imino-1,2-thiazolidine 1-oxide
SMILES[H]N=S1(=O)CCCN1CC
InChIInChI=1S/C5H12N2OS/c1-2-7-4-3-5-9(7,6)8/h6H,2-5H2,1H3
InChIKeyQIZVUSUBBWOUBQ-UHFFFAOYSA-N
MW148.23 g/mol
LogP0.67
Rot. Bonds1

About 2-ethyl-1-imino-1,2-thiazolidine 1-oxide

2-ethyl-1-imino-1,2-thiazolidine 1-oxide (PubChem CID 134485221) has the molecular formula C5H12N2OS and a molecular weight of 148.23 g/mol. Its IUPAC name is 2-ethyl-1-imino-1,2-thiazolidine 1-oxide.

Molecular Properties

Compound Name2-ethyl-1-imino-1,2-thiazolidine 1-oxide
PubChem CID134485221
Molecular FormulaC5H12N2OS
Molecular Weight148.23 g/mol
Exact Mass148.07
IUPAC Name2-ethyl-1-imino-1,2-thiazolidine 1-oxide
SMILES[H]N=S1(=O)CCCN1CC
InChIInChI=1S/C5H12N2OS/c1-2-7-4-3-5-9(7,6)8/h6H,2-5H2,1H3
InChIKeyQIZVUSUBBWOUBQ-UHFFFAOYSA-N
XLogP0.67
TPSA44.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.23
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-imino-1,2-thiazolidine 1-oxide?
The IUPAC name of 2-ethyl-1-imino-1,2-thiazolidine 1-oxide (CID 134485221) is 2-ethyl-1-imino-1,2-thiazolidine 1-oxide.
What is the SMILES notation for 2-ethyl-1-imino-1,2-thiazolidine 1-oxide?
The canonical SMILES for 2-ethyl-1-imino-1,2-thiazolidine 1-oxide is [H]N=S1(=O)CCCN1CC.
What is the InChIKey of 2-ethyl-1-imino-1,2-thiazolidine 1-oxide?
The InChIKey is QIZVUSUBBWOUBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2OS/c1-2-7-4-3-5-9(7,6)8/h6H,2-5H2,1H3.
What are the key properties of 2-ethyl-1-imino-1,2-thiazolidine 1-oxide?
2-ethyl-1-imino-1,2-thiazolidine 1-oxide has a molecular weight of 148.23 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-imino-1,2-thiazolidine 1-oxide is sourced from PubChem (CID 134485221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).