N,N-dimethylthiohydroxylamine

C2H7NS — CID 18780471

IUPACN,N-dimethylthiohydroxylamine
SMILESCN(C)S
InChIInChI=1S/C2H7NS/c1-3(2)4/h4H,1-2H3
InChIKeyJKTHTZCPLANQBH-UHFFFAOYSA-N
MW77.15 g/mol
LogP0.39
Rot. Bonds

About N,N-dimethylthiohydroxylamine

N,N-dimethylthiohydroxylamine (PubChem CID 18780471) has the molecular formula C2H7NS and a molecular weight of 77.15 g/mol. Its IUPAC name is N,N-dimethylthiohydroxylamine.

Molecular Properties

Compound NameN,N-dimethylthiohydroxylamine
PubChem CID18780471
Molecular FormulaC2H7NS
Molecular Weight77.15 g/mol
Exact Mass77.03
IUPAC NameN,N-dimethylthiohydroxylamine
SMILESCN(C)S
InChIInChI=1S/C2H7NS/c1-3(2)4/h4H,1-2H3
InChIKeyJKTHTZCPLANQBH-UHFFFAOYSA-N
XLogP0.39
TPSA3.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50077.15
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N,N-dimethylthiohydroxylamine;methoxysilane
CID 174748218
N-methyl-N-(trichloromethyl)thiohydroxylamine
CID 88816877
N-methyl-N-sulfanylformamide chloride
CID 23317739
tetrakis(dimethylamino)gallanuide
CID 71311174
CID 174722284
CID 174722284
trichloranium;N,N-dimethylmethanamine
CID 172718165
N,N-dimethylmethanamine;trihydrochloride
CID 173321410
N,N-dimethylmethanamine;ethane
CID 23120641
1,1,3-trimethyl-3-sulfanylurea
CID 88793669
sodium N-methyl-N-sulfanylcarbamodithioate
CID 172812180
N,N-dimethylmethanamine;phosphane;dihydrochloride
CID 174651183
alumane;N,N-dimethylmethanamine;dihydrochloride
CID 175552455

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylthiohydroxylamine?
The IUPAC name of N,N-dimethylthiohydroxylamine (CID 18780471) is N,N-dimethylthiohydroxylamine.
What is the SMILES notation for N,N-dimethylthiohydroxylamine?
The canonical SMILES for N,N-dimethylthiohydroxylamine is CN(C)S.
What is the InChIKey of N,N-dimethylthiohydroxylamine?
The InChIKey is JKTHTZCPLANQBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7NS/c1-3(2)4/h4H,1-2H3.
What are the key properties of N,N-dimethylthiohydroxylamine?
N,N-dimethylthiohydroxylamine has a molecular weight of 77.15 g/mol, XLogP of 0.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylthiohydroxylamine is sourced from PubChem (CID 18780471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).