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

C3H9Cl2N3S — CID 70437813

IUPAC4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride
SMILESCl.Cl.NNC1=NCCS1
InChIInChI=1S/C3H7N3S.2ClH/c4-6-3-5-1-2-7-3;;/h1-2,4H2,(H,5,6);2*1H
InChIKeySBROSBAXBPBMMN-UHFFFAOYSA-N
MW190.10 g/mol
LogP0.40
Rot. Bonds

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

4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride (PubChem CID 70437813) has the molecular formula C3H9Cl2N3S and a molecular weight of 190.10 g/mol. Its IUPAC name is 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride.

Molecular Properties

Compound Name4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride
PubChem CID70437813
Molecular FormulaC3H9Cl2N3S
Molecular Weight190.10 g/mol
Exact Mass188.99
IUPAC Name4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride
SMILESCl.Cl.NNC1=NCCS1
InChIInChI=1S/C3H7N3S.2ClH/c4-6-3-5-1-2-7-3;;/h1-2,4H2,(H,5,6);2*1H
InChIKeySBROSBAXBPBMMN-UHFFFAOYSA-N
XLogP0.40
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.10
LogP ≤ 50.40
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;dihydrochloride?
The IUPAC name of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride (CID 70437813) is 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride.
What is the SMILES notation for 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride?
The canonical SMILES for 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride is Cl.Cl.NNC1=NCCS1.
What is the InChIKey of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride?
The InChIKey is SBROSBAXBPBMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7N3S.2ClH/c4-6-3-5-1-2-7-3;;/h1-2,4H2,(H,5,6);2*1H.
What are the key properties of 4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride?
4,5-dihydro-1,3-thiazol-2-ylhydrazine;dihydrochloride has a molecular weight of 190.10 g/mol, XLogP of 0.40, 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;dihydrochloride is sourced from PubChem (CID 70437813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).