(ethylsulfamoylamino)methanol

C3H10N2O3S — CID 117126069

IUPAC(ethylsulfamoylamino)methanol
SMILESCCNS(=O)(=O)NCO
InChIInChI=1S/C3H10N2O3S/c1-2-4-9(7,8)5-3-6/h4-6H,2-3H2,1H3
InChIKeyFUUHEFAFEKAWTK-UHFFFAOYSA-N
MW154.19 g/mol
LogP-1.62
Rot. Bonds4

About (ethylsulfamoylamino)methanol

(ethylsulfamoylamino)methanol (PubChem CID 117126069) has the molecular formula C3H10N2O3S and a molecular weight of 154.19 g/mol. Its IUPAC name is (ethylsulfamoylamino)methanol.

Molecular Properties

Compound Name(ethylsulfamoylamino)methanol
PubChem CID117126069
Molecular FormulaC3H10N2O3S
Molecular Weight154.19 g/mol
Exact Mass154.04
IUPAC Name(ethylsulfamoylamino)methanol
SMILESCCNS(=O)(=O)NCO
InChIInChI=1S/C3H10N2O3S/c1-2-4-9(7,8)5-3-6/h4-6H,2-3H2,1H3
InChIKeyFUUHEFAFEKAWTK-UHFFFAOYSA-N
XLogP-1.62
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 5-1.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (ethylsulfamoylamino)methanol?
The IUPAC name of (ethylsulfamoylamino)methanol (CID 117126069) is (ethylsulfamoylamino)methanol.
What is the SMILES notation for (ethylsulfamoylamino)methanol?
The canonical SMILES for (ethylsulfamoylamino)methanol is CCNS(=O)(=O)NCO.
What is the InChIKey of (ethylsulfamoylamino)methanol?
The InChIKey is FUUHEFAFEKAWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H10N2O3S/c1-2-4-9(7,8)5-3-6/h4-6H,2-3H2,1H3.
What are the key properties of (ethylsulfamoylamino)methanol?
(ethylsulfamoylamino)methanol has a molecular weight of 154.19 g/mol, XLogP of -1.62, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (ethylsulfamoylamino)methanol is sourced from PubChem (CID 117126069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).