1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide

C9H20N2O3S — CID 106072560

IUPAC1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NC1CCOC1
InChIInChI=1S/C9H20N2O3S/c1-3-10-6-8(2)15(12,13)11-9-4-5-14-7-9/h8-11H,3-7H2,1-2H3
InChIKeyIQMNJOLEGARNON-UHFFFAOYSA-N
MW236.34 g/mol
LogP-0.31
Rot. Bonds6

About 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide

1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide (PubChem CID 106072560) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide
PubChem CID106072560
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide
SMILESCCNCC(C)S(=O)(=O)NC1CCOC1
InChIInChI=1S/C9H20N2O3S/c1-3-10-6-8(2)15(12,13)11-9-4-5-14-7-9/h8-11H,3-7H2,1-2H3
InChIKeyIQMNJOLEGARNON-UHFFFAOYSA-N
XLogP-0.31
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-dimethyloxan-4-yl)-1-(ethylamino)propane-2-sulfonamide
CID 106075173
1-(ethylamino)-N-(thian-4-yl)propane-2-sulfonamide
CID 106084518
N-(oxan-3-yl)-1-(propan-2-ylamino)propane-2-sulfonamide
CID 106065267
1-(ethylamino)-N-(3,3,5,5-tetramethylcyclohexyl)propane-2-sulfonamide
CID 106077364
N-(2,3-dimethylcyclohexyl)-1-(ethylamino)propane-2-sulfonamide
CID 106060304
5-(ethylaminomethyl)-N-(oxolan-3-yl)-1-propan-2-ylpyrrole-3-sulfonamide
CID 106072593
N-(3,4-dimethylcyclohexyl)-1-(propylamino)propane-2-sulfonamide
CID 106067403
N-cyclooctyl-1-(cyclopropylamino)propane-2-sulfonamide
CID 106058802
N-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl)-1-(ethylamino)propane-2-sulfonamide
CID 106004615
N-cyclohexylbutane-2-sulfonamide
CID 59716186
3-(ethylamino)-2-methyl-1-(oxolan-3-yl)propan-1-one
CID 116565198
1-(ethylamino)-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonamide
CID 106019118

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide?
The IUPAC name of 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide (CID 106072560) is 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide.
What is the SMILES notation for 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide?
The canonical SMILES for 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide is CCNCC(C)S(=O)(=O)NC1CCOC1.
What is the InChIKey of 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide?
The InChIKey is IQMNJOLEGARNON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-3-10-6-8(2)15(12,13)11-9-4-5-14-7-9/h8-11H,3-7H2,1-2H3.
What are the key properties of 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide?
1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide has a molecular weight of 236.34 g/mol, XLogP of -0.31, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-N-(oxolan-3-yl)propane-2-sulfonamide is sourced from PubChem (CID 106072560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).