5-methyl-1,3-thiazolidine;thiophene

C8H13NS2 — CID 161487436

IUPAC5-methyl-1,3-thiazolidine;thiophene
SMILESCC1CNCS1.c1ccsc1
InChIInChI=1S/C4H9NS.C4H4S/c1-4-2-5-3-6-4;1-2-4-5-3-1/h4-5H,2-3H2,1H3;1-4H
InChIKeyWFDSKPHXRWPHCD-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.42
Rot. Bonds

About 5-methyl-1,3-thiazolidine;thiophene

5-methyl-1,3-thiazolidine;thiophene (PubChem CID 161487436) has the molecular formula C8H13NS2 and a molecular weight of 187.33 g/mol. Its IUPAC name is 5-methyl-1,3-thiazolidine;thiophene.

Molecular Properties

Compound Name5-methyl-1,3-thiazolidine;thiophene
PubChem CID161487436
Molecular FormulaC8H13NS2
Molecular Weight187.33 g/mol
Exact Mass187.05
IUPAC Name5-methyl-1,3-thiazolidine;thiophene
SMILESCC1CNCS1.c1ccsc1
InChIInChI=1S/C4H9NS.C4H4S/c1-4-2-5-3-6-4;1-2-4-5-3-1/h4-5H,2-3H2,1H3;1-4H
InChIKeyWFDSKPHXRWPHCD-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,3-thiazolidine;thiophene?
The IUPAC name of 5-methyl-1,3-thiazolidine;thiophene (CID 161487436) is 5-methyl-1,3-thiazolidine;thiophene.
What is the SMILES notation for 5-methyl-1,3-thiazolidine;thiophene?
The canonical SMILES for 5-methyl-1,3-thiazolidine;thiophene is CC1CNCS1.c1ccsc1.
What is the InChIKey of 5-methyl-1,3-thiazolidine;thiophene?
The InChIKey is WFDSKPHXRWPHCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NS.C4H4S/c1-4-2-5-3-6-4;1-2-4-5-3-1/h4-5H,2-3H2,1H3;1-4H.
What are the key properties of 5-methyl-1,3-thiazolidine;thiophene?
5-methyl-1,3-thiazolidine;thiophene has a molecular weight of 187.33 g/mol, XLogP of 2.42, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,3-thiazolidine;thiophene is sourced from PubChem (CID 161487436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).