N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide

C3H10NO3S2- — CID 20716949

IUPACN-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide
SMILESCS(C)([O-])NS(C)(=O)=O
InChIInChI=1S/C3H11NO3S2/c1-8(2,5)4-9(3,6)7/h4-5H,1-3H3/p-1
InChIKeyCVESWBVAZFQHID-UHFFFAOYSA-M
MW172.25 g/mol
LogP-0.35
Rot. Bonds2

About N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide

N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide (PubChem CID 20716949) has the molecular formula C3H10NO3S2- and a molecular weight of 172.25 g/mol. Its IUPAC name is N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide.

Molecular Properties

Compound NameN-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide
PubChem CID20716949
Molecular FormulaC3H10NO3S2-
Molecular Weight172.25 g/mol
Exact Mass172.01
IUPAC NameN-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide
SMILESCS(C)([O-])NS(C)(=O)=O
InChIInChI=1S/C3H11NO3S2/c1-8(2,5)4-9(3,6)7/h4-5H,1-3H3/p-1
InChIKeyCVESWBVAZFQHID-UHFFFAOYSA-M
XLogP-0.35
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 5-0.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide?
The IUPAC name of N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide (CID 20716949) is N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide.
What is the SMILES notation for N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide?
The canonical SMILES for N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide is CS(C)([O-])NS(C)(=O)=O.
What is the InChIKey of N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide?
The InChIKey is CVESWBVAZFQHID-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H11NO3S2/c1-8(2,5)4-9(3,6)7/h4-5H,1-3H3/p-1.
What are the key properties of N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide?
N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide has a molecular weight of 172.25 g/mol, XLogP of -0.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethyl(oxido)-λ4-sulfanyl]methanesulfonamide is sourced from PubChem (CID 20716949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).