N-methyl-N-tritiothiohydroxylamine

CH5NS — CID 167664935

IUPACN-methyl-N-tritiothiohydroxylamine
SMILES[3H]N(C)S
InChIInChI=1S/CH5NS/c1-2-3/h2-3H,1H3/i/hT
InChIKeyDJNSXGBGUVWIDF-MNYXATJNSA-N
MW65.13 g/mol
LogP0.05
Rot. Bonds

About N-methyl-N-tritiothiohydroxylamine

N-methyl-N-tritiothiohydroxylamine (PubChem CID 167664935) has the molecular formula CH5NS and a molecular weight of 65.13 g/mol. Its IUPAC name is N-methyl-N-tritiothiohydroxylamine.

Molecular Properties

Compound NameN-methyl-N-tritiothiohydroxylamine
PubChem CID167664935
Molecular FormulaCH5NS
Molecular Weight65.13 g/mol
Exact Mass65.02
IUPAC NameN-methyl-N-tritiothiohydroxylamine
SMILES[3H]N(C)S
InChIInChI=1S/CH5NS/c1-2-3/h2-3H,1H3/i/hT
InChIKeyDJNSXGBGUVWIDF-MNYXATJNSA-N
XLogP0.05
TPSA12.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50065.13
LogP ≤ 50.05
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

Methylamino thiamine
CID 20090145
Methanamine;sulfane
CID 12548554
N-(disulfanyl)methanamine
CID 88472867
Methylamino thiohypoiodite
CID 90273568
Methyl(sulfido)azanium
CID 100968256
CID 123180538
CID 123180538
Methylamino(oxo)sulfanium
CID 143990106
S-(methylamino)thiohydroxylamine
CID 144160836
Methylamino thiohypochlorite
CID 144977915
N-(tritiomethyl)thiohydroxylamine
CID 157084808
Methanidyl(sulfanyl)azanium
CID 172739267
N-methylthiohydroxylamine;hydrochloride
CID 174145720

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-tritiothiohydroxylamine?
The IUPAC name of N-methyl-N-tritiothiohydroxylamine (CID 167664935) is N-methyl-N-tritiothiohydroxylamine.
What is the SMILES notation for N-methyl-N-tritiothiohydroxylamine?
The canonical SMILES for N-methyl-N-tritiothiohydroxylamine is [3H]N(C)S.
What is the InChIKey of N-methyl-N-tritiothiohydroxylamine?
The InChIKey is DJNSXGBGUVWIDF-MNYXATJNSA-N. The full InChI is InChI=1S/CH5NS/c1-2-3/h2-3H,1H3/i/hT.
What are the key properties of N-methyl-N-tritiothiohydroxylamine?
N-methyl-N-tritiothiohydroxylamine has a molecular weight of 65.13 g/mol, XLogP of 0.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-tritiothiohydroxylamine is sourced from PubChem (CID 167664935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).