1-cyclopropyl-2-(methylsulfamoylamino)ethanol

C6H14N2O3S — CID 114809504

IUPAC1-cyclopropyl-2-(methylsulfamoylamino)ethanol
SMILESCNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C6H14N2O3S/c1-7-12(10,11)8-4-6(9)5-2-3-5/h5-9H,2-4H2,1H3
InChIKeyUPOQUSOXYLDGIL-UHFFFAOYSA-N
MW194.26 g/mol
LogP-1.19
Rot. Bonds5

About 1-cyclopropyl-2-(methylsulfamoylamino)ethanol

1-cyclopropyl-2-(methylsulfamoylamino)ethanol (PubChem CID 114809504) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 1-cyclopropyl-2-(methylsulfamoylamino)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(methylsulfamoylamino)ethanol
PubChem CID114809504
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name1-cyclopropyl-2-(methylsulfamoylamino)ethanol
SMILESCNS(=O)(=O)NCC(O)C1CC1
InChIInChI=1S/C6H14N2O3S/c1-7-12(10,11)8-4-6(9)5-2-3-5/h5-9H,2-4H2,1H3
InChIKeyUPOQUSOXYLDGIL-UHFFFAOYSA-N
XLogP-1.19
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-1.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(methylsulfamoylamino)ethanol?
The IUPAC name of 1-cyclopropyl-2-(methylsulfamoylamino)ethanol (CID 114809504) is 1-cyclopropyl-2-(methylsulfamoylamino)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(methylsulfamoylamino)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(methylsulfamoylamino)ethanol is CNS(=O)(=O)NCC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(methylsulfamoylamino)ethanol?
The InChIKey is UPOQUSOXYLDGIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-7-12(10,11)8-4-6(9)5-2-3-5/h5-9H,2-4H2,1H3.
What are the key properties of 1-cyclopropyl-2-(methylsulfamoylamino)ethanol?
1-cyclopropyl-2-(methylsulfamoylamino)ethanol has a molecular weight of 194.26 g/mol, XLogP of -1.19, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(methylsulfamoylamino)ethanol is sourced from PubChem (CID 114809504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).