4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide

C3H8BrN3S — CID 2774303

IUPAC4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide
SMILESBr.NNC1=NCCS1
InChIInChI=1S/C3H7N3S.BrH/c4-6-3-5-1-2-7-3;/h1-2,4H2,(H,5,6);1H
InChIKeyXYTRVFMNMJPWQV-UHFFFAOYSA-N
MW198.09 g/mol
LogP0.13
Rot. Bonds

About 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide

4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide (PubChem CID 2774303) has the molecular formula C3H8BrN3S and a molecular weight of 198.09 g/mol. Its IUPAC name is 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide.

Molecular Properties

Compound Name4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide
PubChem CID2774303
Molecular FormulaC3H8BrN3S
Molecular Weight198.09 g/mol
Exact Mass196.96
IUPAC Name4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide
SMILESBr.NNC1=NCCS1
InChIInChI=1S/C3H7N3S.BrH/c4-6-3-5-1-2-7-3;/h1-2,4H2,(H,5,6);1H
InChIKeyXYTRVFMNMJPWQV-UHFFFAOYSA-N
XLogP0.13
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.09
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide?
The IUPAC name of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide (CID 2774303) is 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide.
What is the SMILES notation for 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide?
The canonical SMILES for 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide is Br.NNC1=NCCS1.
What is the InChIKey of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide?
The InChIKey is XYTRVFMNMJPWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N3S.BrH/c4-6-3-5-1-2-7-3;/h1-2,4H2,(H,5,6);1H.
What are the key properties of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide?
4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide has a molecular weight of 198.09 g/mol, XLogP of 0.13, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-thiazol-2-ylhydrazine;hydrobromide is sourced from PubChem (CID 2774303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).