3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide

C10H22N2O3S — CID 61435361

IUPAC3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide
SMILESCCN(CC1CCCO1)S(=O)(=O)CCCN
InChIInChI=1S/C10H22N2O3S/c1-2-12(9-10-5-3-7-15-10)16(13,14)8-4-6-11/h10H,2-9,11H2,1H3
InChIKeyKMISPMBIJDYXCW-UHFFFAOYSA-N
MW250.36 g/mol
LogP0.17
Rot. Bonds7

About 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide

3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide (PubChem CID 61435361) has the molecular formula C10H22N2O3S and a molecular weight of 250.36 g/mol. Its IUPAC name is 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide.

Molecular Properties

Compound Name3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide
PubChem CID61435361
Molecular FormulaC10H22N2O3S
Molecular Weight250.36 g/mol
Exact Mass250.14
IUPAC Name3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide
SMILESCCN(CC1CCCO1)S(=O)(=O)CCCN
InChIInChI=1S/C10H22N2O3S/c1-2-12(9-10-5-3-7-15-10)16(13,14)8-4-6-11/h10H,2-9,11H2,1H3
InChIKeyKMISPMBIJDYXCW-UHFFFAOYSA-N
XLogP0.17
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-amino-N-ethyl-N-(oxolan-2-ylmethyl)butane-1-sulfonamide
CID 54951943
N-methyl-N-(oxolan-2-ylmethyl)butane-1-sulfonamide
CID 110733190
1-(4-chlorophenyl)-N-ethyl-N-(oxan-2-ylmethyl)methanesulfonamide
CID 131952531
N'-(oxolan-2-ylmethyl)-N'-propylpropane-1,3-diamine
CID 43137301
4-amino-2,6-dibromo-N-ethyl-N-(oxolan-2-ylmethyl)benzenesulfonamide
CID 61434089
N-methyl-N-[[(2R)-oxan-2-yl]methyl]pentane-1-sulfonamide
CID 97306297
5-amino-N-ethyl-2-methyl-N-(oxolan-2-ylmethyl)benzenesulfonamide
CID 61433419
N'-methyl-N'-[methyl(oxan-2-ylmethyl)sulfamoyl]propane-1,3-diamine
CID 54951890
3-amino-N-ethyl-N-propylpropane-1-sulfonamide
CID 60910344
N-[2-[methylsulfonyl(oxolan-2-ylmethyl)amino]ethyl]butane-1-sulfonamide
CID 113066194
N-(3-aminopropyl)-3-[ethyl(oxolan-2-ylmethyl)amino]-N-methylpropanamide
CID 61433794
(2S,5R)-5-(aminomethyl)-N-ethyl-N-(oxolan-2-ylmethyl)oxolane-2-carboxamide
CID 120789898

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide?
The IUPAC name of 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide (CID 61435361) is 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide.
What is the SMILES notation for 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide?
The canonical SMILES for 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide is CCN(CC1CCCO1)S(=O)(=O)CCCN.
What is the InChIKey of 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide?
The InChIKey is KMISPMBIJDYXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3S/c1-2-12(9-10-5-3-7-15-10)16(13,14)8-4-6-11/h10H,2-9,11H2,1H3.
What are the key properties of 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide?
3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide has a molecular weight of 250.36 g/mol, XLogP of 0.17, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-ethyl-N-(oxolan-2-ylmethyl)propane-1-sulfonamide is sourced from PubChem (CID 61435361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).