methyl(sulfido)azanium

CH5NS — CID 100968256

IUPACmethyl(sulfido)azanium
SMILESC[NH2+][S-]
InChIInChI=1S/CH5NS/c1-2-3/h2H2,1H3
InChIKeyOUIZLSGSXCBSBS-UHFFFAOYSA-N
MW63.12 g/mol
LogP-1.36
Rot. Bonds

About methyl(sulfido)azanium

methyl(sulfido)azanium (PubChem CID 100968256) has the molecular formula CH5NS and a molecular weight of 63.12 g/mol. Its IUPAC name is methyl(sulfido)azanium.

Molecular Properties

Compound Namemethyl(sulfido)azanium
PubChem CID100968256
Molecular FormulaCH5NS
Molecular Weight63.12 g/mol
Exact Mass63.01
IUPAC Namemethyl(sulfido)azanium
SMILESC[NH2+][S-]
InChIInChI=1S/CH5NS/c1-2-3/h2H2,1H3
InChIKeyOUIZLSGSXCBSBS-UHFFFAOYSA-N
XLogP-1.36
TPSA16.61 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.12
LogP ≤ 5-1.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methyl(sulfido)azanium?
The IUPAC name of methyl(sulfido)azanium (CID 100968256) is methyl(sulfido)azanium.
What is the SMILES notation for methyl(sulfido)azanium?
The canonical SMILES for methyl(sulfido)azanium is C[NH2+][S-].
What is the InChIKey of methyl(sulfido)azanium?
The InChIKey is OUIZLSGSXCBSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5NS/c1-2-3/h2H2,1H3.
What are the key properties of methyl(sulfido)azanium?
methyl(sulfido)azanium has a molecular weight of 63.12 g/mol, XLogP of -1.36, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(sulfido)azanium is sourced from PubChem (CID 100968256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).