cyclohexane;thiohydroxylamine

C6H15NS — CID 142523314

IUPACcyclohexane;thiohydroxylamine
SMILESC1CCCCC1.NS
InChIInChI=1S/C6H12.H3NS/c1-2-4-6-5-3-1;1-2/h1-6H2;2H,1H2
InChIKeyMAKWZVSBDJQPAT-UHFFFAOYSA-N
MW133.26 g/mol
LogP2.13
Rot. Bonds

About cyclohexane;thiohydroxylamine

cyclohexane;thiohydroxylamine (PubChem CID 142523314) has the molecular formula C6H15NS and a molecular weight of 133.26 g/mol. Its IUPAC name is cyclohexane;thiohydroxylamine.

Molecular Properties

Compound Namecyclohexane;thiohydroxylamine
PubChem CID142523314
Molecular FormulaC6H15NS
Molecular Weight133.26 g/mol
Exact Mass133.09
IUPAC Namecyclohexane;thiohydroxylamine
SMILESC1CCCCC1.NS
InChIInChI=1S/C6H12.H3NS/c1-2-4-6-5-3-1;1-2/h1-6H2;2H,1H2
InChIKeyMAKWZVSBDJQPAT-UHFFFAOYSA-N
XLogP2.13
TPSA26.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.26
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

cyclobutane;cyclopropane
CID 159057906
cyclooctacosane
CID 520451
cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane
CID 159212715
cyclooctane
CID 9266
cyclopentane
CID 141332554
cycloheptane;cyclopropane
CID 165090184
cyclohexanamine;thiohydroxylamine
CID 143520299
cyclohexane;methanamine
CID 18619744
cyclobutane;methanethiol
CID 158083106
cyclobutane;methanethiol
CID 158406049
cyclohexane;hydrazine;platinum;dihydrate
CID 175390708
cyclobutane;sulfane
CID 23347574

Frequently Asked Questions

What is the IUPAC name of cyclohexane;thiohydroxylamine?
The IUPAC name of cyclohexane;thiohydroxylamine (CID 142523314) is cyclohexane;thiohydroxylamine.
What is the SMILES notation for cyclohexane;thiohydroxylamine?
The canonical SMILES for cyclohexane;thiohydroxylamine is C1CCCCC1.NS.
What is the InChIKey of cyclohexane;thiohydroxylamine?
The InChIKey is MAKWZVSBDJQPAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.H3NS/c1-2-4-6-5-3-1;1-2/h1-6H2;2H,1H2.
What are the key properties of cyclohexane;thiohydroxylamine?
cyclohexane;thiohydroxylamine has a molecular weight of 133.26 g/mol, XLogP of 2.13, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;thiohydroxylamine is sourced from PubChem (CID 142523314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).