1-methylsulfonyl-2-(sulfamoylamino)ethane

C3H10N2O4S2 — CID 112688958

IUPAC1-methylsulfonyl-2-(sulfamoylamino)ethane
SMILESCS(=O)(=O)CCNS(N)(=O)=O
InChIInChI=1S/C3H10N2O4S2/c1-10(6,7)3-2-5-11(4,8)9/h5H,2-3H2,1H3,(H2,4,8,9)
InChIKeyUGFASZNXHHUKNC-UHFFFAOYSA-N
MW202.26 g/mol
LogP-2.18
Rot. Bonds4

About 1-methylsulfonyl-2-(sulfamoylamino)ethane

1-methylsulfonyl-2-(sulfamoylamino)ethane (PubChem CID 112688958) has the molecular formula C3H10N2O4S2 and a molecular weight of 202.26 g/mol. Its IUPAC name is 1-methylsulfonyl-2-(sulfamoylamino)ethane.

Molecular Properties

Compound Name1-methylsulfonyl-2-(sulfamoylamino)ethane
PubChem CID112688958
Molecular FormulaC3H10N2O4S2
Molecular Weight202.26 g/mol
Exact Mass202.01
IUPAC Name1-methylsulfonyl-2-(sulfamoylamino)ethane
SMILESCS(=O)(=O)CCNS(N)(=O)=O
InChIInChI=1S/C3H10N2O4S2/c1-10(6,7)3-2-5-11(4,8)9/h5H,2-3H2,1H3,(H2,4,8,9)
InChIKeyUGFASZNXHHUKNC-UHFFFAOYSA-N
XLogP-2.18
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 5-2.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methylsulfonyl-3-(sulfamoylamino)propane
CID 112686404
N-(2-methylsulfonylethylsulfamoyl)propan-2-amine
CID 110612472
(3S)-3-hydroxy-1-(sulfamoylamino)butane
CID 130638479
3-(sulfamoylamino)propane-1-sulfonamide
CID 112689045
N-(2-methylsulfonylethyl)propan-2-amine
CID 60708370
(2R)-2-N-(2-methylsulfonylethyl)propane-1,2-diamine
CID 104867919
ethane;N-(2-methylsulfonylethyl)propan-2-amine
CID 142531419
azane;1-(sulfamoylamino)pentane
CID 87509026
2-amino-N-(2-methylsulfonylethyl)pyrimidine-5-sulfonamide
CID 62162959
4-amino-2,6-dimethyl-N-(2-methylsulfonylethyl)benzenesulfonamide
CID 79588681
1-(propan-2-ylamino)-3-(sulfamoylamino)propane
CID 114959323
1-(sulfamoylamino)octane;hydrofluoride
CID 175085495

Frequently Asked Questions

What is the IUPAC name of 1-methylsulfonyl-2-(sulfamoylamino)ethane?
The IUPAC name of 1-methylsulfonyl-2-(sulfamoylamino)ethane (CID 112688958) is 1-methylsulfonyl-2-(sulfamoylamino)ethane.
What is the SMILES notation for 1-methylsulfonyl-2-(sulfamoylamino)ethane?
The canonical SMILES for 1-methylsulfonyl-2-(sulfamoylamino)ethane is CS(=O)(=O)CCNS(N)(=O)=O.
What is the InChIKey of 1-methylsulfonyl-2-(sulfamoylamino)ethane?
The InChIKey is UGFASZNXHHUKNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O4S2/c1-10(6,7)3-2-5-11(4,8)9/h5H,2-3H2,1H3,(H2,4,8,9).
What are the key properties of 1-methylsulfonyl-2-(sulfamoylamino)ethane?
1-methylsulfonyl-2-(sulfamoylamino)ethane has a molecular weight of 202.26 g/mol, XLogP of -2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylsulfonyl-2-(sulfamoylamino)ethane is sourced from PubChem (CID 112688958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).