2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide

C5H10BrN5S — CID 175071452

IUPAC2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide
SMILESBr.Cc1nnnn1C1NCCS1
InChIInChI=1S/C5H9N5S.BrH/c1-4-7-8-9-10(4)5-6-2-3-11-5;/h5-6H,2-3H2,1H3;1H
InChIKeyBCGWGUXMWSJBAM-UHFFFAOYSA-N
MW252.14 g/mol
LogP0.35
Rot. Bonds1

About 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide

2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide (PubChem CID 175071452) has the molecular formula C5H10BrN5S and a molecular weight of 252.14 g/mol. Its IUPAC name is 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide.

Molecular Properties

Compound Name2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide
PubChem CID175071452
Molecular FormulaC5H10BrN5S
Molecular Weight252.14 g/mol
Exact Mass250.98
IUPAC Name2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide
SMILESBr.Cc1nnnn1C1NCCS1
InChIInChI=1S/C5H9N5S.BrH/c1-4-7-8-9-10(4)5-6-2-3-11-5;/h5-6H,2-3H2,1H3;1H
InChIKeyBCGWGUXMWSJBAM-UHFFFAOYSA-N
XLogP0.35
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.14
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide?
The IUPAC name of 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide (CID 175071452) is 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide.
What is the SMILES notation for 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide?
The canonical SMILES for 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide is Br.Cc1nnnn1C1NCCS1.
What is the InChIKey of 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide?
The InChIKey is BCGWGUXMWSJBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5S.BrH/c1-4-7-8-9-10(4)5-6-2-3-11-5;/h5-6H,2-3H2,1H3;1H.
What are the key properties of 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide?
2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide has a molecular weight of 252.14 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyltetrazol-1-yl)-1,3-thiazolidine;hydrobromide is sourced from PubChem (CID 175071452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).