5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide

C11H20N2O4S — CID 63905160

IUPAC5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(CNC(C)(C)CO)o1
InChIInChI=1S/C11H20N2O4S/c1-11(2,8-14)12-7-9-5-6-10(17-9)18(15,16)13(3)4/h5-6,12,14H,7-8H2,1-4H3
InChIKeyAAWXNGXJSKLBER-UHFFFAOYSA-N
MW276.36 g/mol
LogP0.39
Rot. Bonds6

About 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide

5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide (PubChem CID 63905160) has the molecular formula C11H20N2O4S and a molecular weight of 276.36 g/mol. Its IUPAC name is 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide.

Molecular Properties

Compound Name5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide
PubChem CID63905160
Molecular FormulaC11H20N2O4S
Molecular Weight276.36 g/mol
Exact Mass276.11
IUPAC Name5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide
SMILESCN(C)S(=O)(=O)c1ccc(CNC(C)(C)CO)o1
InChIInChI=1S/C11H20N2O4S/c1-11(2,8-14)12-7-9-5-6-10(17-9)18(15,16)13(3)4/h5-6,12,14H,7-8H2,1-4H3
InChIKeyAAWXNGXJSKLBER-UHFFFAOYSA-N
XLogP0.39
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 50.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-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

2-[(5-aminofuran-2-yl)methylamino]-2-methylpropan-1-ol
CID 82344574
N,N-dimethyl-5-[[(2-methyl-3-pyridinyl)amino]methyl]furan-2-sulfonamide
CID 79042214
5-[[5-(dimethylsulfamoyl)furan-2-yl]methylamino]pentanamide
CID 106233401
5-[[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino]methyl]-N-methylfuran-2-sulfonamide
CID 107850325
N,N-dimethyl-5-[[3-[methyl(propan-2-yl)amino]propylamino]methyl]furan-2-sulfonamide
CID 106040255
5-[[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]amino]methyl]furan-2-sulfonamide
CID 107865049
N,N-dimethyl-5-[[1-(oxan-4-yl)ethylamino]methyl]furan-2-sulfonamide
CID 103914756
N,N-dimethyl-5-[[1-(1H-1,2,4-triazol-5-yl)ethylamino]methyl]furan-2-sulfonamide
CID 106281628
5-[[(1,1-dioxothiolan-2-yl)methylamino]methyl]-N,N-dimethylfuran-2-sulfonamide
CID 81042035
N,N-dimethyl-5-[(2-thiomorpholin-4-ylethylamino)methyl]furan-2-sulfonamide
CID 106324582
5-[(3-cyano-3-methylbutyl)sulfanylmethyl]-N,N-dimethylfuran-2-sulfonamide
CID 91662631
3-[5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]furan-2-yl]benzoic acid;hydrochloride
CID 17212789

Frequently Asked Questions

What is the IUPAC name of 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide?
The IUPAC name of 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide (CID 63905160) is 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide.
What is the SMILES notation for 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide?
The canonical SMILES for 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide is CN(C)S(=O)(=O)c1ccc(CNC(C)(C)CO)o1.
What is the InChIKey of 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide?
The InChIKey is AAWXNGXJSKLBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O4S/c1-11(2,8-14)12-7-9-5-6-10(17-9)18(15,16)13(3)4/h5-6,12,14H,7-8H2,1-4H3.
What are the key properties of 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide?
5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide has a molecular weight of 276.36 g/mol, XLogP of 0.39, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]-N,N-dimethylfuran-2-sulfonamide is sourced from PubChem (CID 63905160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).