hydron;thian-4-ylhydrazine;chloride

C5H13ClN2S — CID 146636568

IUPAChydron;thian-4-ylhydrazine;chloride
SMILESNNC1CCSCC1.[Cl-].[H+]
InChIInChI=1S/C5H12N2S.ClH/c6-7-5-1-3-8-4-2-5;/h5,7H,1-4,6H2;1H
InChIKeyGKVKKLXPZUFGAC-UHFFFAOYSA-N
MW168.69 g/mol
LogP-2.54
Rot. Bonds1

About hydron;thian-4-ylhydrazine;chloride

hydron;thian-4-ylhydrazine;chloride (PubChem CID 146636568) has the molecular formula C5H13ClN2S and a molecular weight of 168.69 g/mol. Its IUPAC name is hydron;thian-4-ylhydrazine;chloride.

Molecular Properties

Compound Namehydron;thian-4-ylhydrazine;chloride
PubChem CID146636568
Molecular FormulaC5H13ClN2S
Molecular Weight168.69 g/mol
Exact Mass168.05
IUPAC Namehydron;thian-4-ylhydrazine;chloride
SMILESNNC1CCSCC1.[Cl-].[H+]
InChIInChI=1S/C5H12N2S.ClH/c6-7-5-1-3-8-4-2-5;/h5,7H,1-4,6H2;1H
InChIKeyGKVKKLXPZUFGAC-UHFFFAOYSA-N
XLogP-2.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.69
LogP ≤ 5-2.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze hydron;thian-4-ylhydrazine;chloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(Thian-4-yl)hydrazine hydrochloride
CID 22593898
(Thiolan-3-yl)hydrazine dihydrochloride
CID 119031358
(Thian-3-yl)hydrazine dihydrochloride
CID 137838599
(Thiolan-3-yl)hydrazine
CID 19432801
(Thian-4-yl)hydrazine
CID 22593899
(Thiolan-3-yl)hydrazine hydrochloride
CID 19432800
1-(Tetrahydro-2-methylthiophen-3-YL)hydrazine
CID 53403133
1-Methylsulfanylpropan-2-ylhydrazine
CID 55281387
(1,1-Dihydroxythian-4-yl)hydrazine;hydrochloride
CID 126619325
Thian-2-ylhydrazine
CID 139947876
1-Chloro-1-(thian-4-yl)hydrazine
CID 175492755
1-Chloro-2-(thian-4-yl)hydrazine
CID 175492779

Frequently Asked Questions

What is the IUPAC name of hydron;thian-4-ylhydrazine;chloride?
The IUPAC name of hydron;thian-4-ylhydrazine;chloride (CID 146636568) is hydron;thian-4-ylhydrazine;chloride.
What is the SMILES notation for hydron;thian-4-ylhydrazine;chloride?
The canonical SMILES for hydron;thian-4-ylhydrazine;chloride is NNC1CCSCC1.[Cl-].[H+].
What is the InChIKey of hydron;thian-4-ylhydrazine;chloride?
The InChIKey is GKVKKLXPZUFGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2S.ClH/c6-7-5-1-3-8-4-2-5;/h5,7H,1-4,6H2;1H.
What are the key properties of hydron;thian-4-ylhydrazine;chloride?
hydron;thian-4-ylhydrazine;chloride has a molecular weight of 168.69 g/mol, XLogP of -2.54, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;thian-4-ylhydrazine;chloride is sourced from PubChem (CID 146636568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).