N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide

C11H25NO3S — CID 103931309

IUPACN-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide
SMILESCC(C)CCS(=O)(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H25NO3S/c1-9(2)7-8-16(14,15)12-10(3,4)11(5,6)13/h9,12-13H,7-8H2,1-6H3
InChIKeyARQFUVKALJNJEC-UHFFFAOYSA-N
MW251.39 g/mol
LogP1.50
Rot. Bonds6

About N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide

N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide (PubChem CID 103931309) has the molecular formula C11H25NO3S and a molecular weight of 251.39 g/mol. Its IUPAC name is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide.

Molecular Properties

Compound NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide
PubChem CID103931309
Molecular FormulaC11H25NO3S
Molecular Weight251.39 g/mol
Exact Mass251.16
IUPAC NameN-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide
SMILESCC(C)CCS(=O)(=O)NC(C)(C)C(C)(C)O
InChIInChI=1S/C11H25NO3S/c1-9(2)7-8-16(14,15)12-10(3,4)11(5,6)13/h9,12-13H,7-8H2,1-6H3
InChIKeyARQFUVKALJNJEC-UHFFFAOYSA-N
XLogP1.50
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.39
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-amino-2-methylpropan-2-yl)-3-methylbutane-1-sulfonamide
CID 63834751
N-(1-amino-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide
CID 115310693
N-(2-hydroxy-2,4-dimethylpentyl)-3-methylbutane-1-sulfonamide
CID 66178801
1-cyclopropyl-N-(3-hydroxy-2,3-dimethylbutan-2-yl)methanesulfonamide
CID 103931299
N-(2-bromo-4,4-dimethylpentyl)-3-methylbutane-1-sulfonamide
CID 107158135
N-[2-(tert-butylamino)ethyl]-3-methylbutane-1-sulfonamide
CID 56795208
N-(1-amino-2-phenylpropan-2-yl)-3-methylbutane-1-sulfonamide
CID 105060592
N-(4-hydroxycyclohexyl)-3-methylbutane-1-sulfonamide
CID 63856243
N-(1-bromo-4,4-dimethylpentan-3-yl)-3-methylbutane-1-sulfonamide
CID 106356613
N-butan-2-yl-3-methylbutane-1-sulfonamide
CID 63373512
N-(3-tert-butylcyclobutyl)-3-methylbutane-1-sulfonamide
CID 156532116
N-[1-(hydroxymethyl)cyclopentyl]-3-methylbutane-1-sulfonamide
CID 63857521

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide?
The IUPAC name of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide (CID 103931309) is N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide.
What is the SMILES notation for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide?
The canonical SMILES for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide is CC(C)CCS(=O)(=O)NC(C)(C)C(C)(C)O.
What is the InChIKey of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide?
The InChIKey is ARQFUVKALJNJEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO3S/c1-9(2)7-8-16(14,15)12-10(3,4)11(5,6)13/h9,12-13H,7-8H2,1-6H3.
What are the key properties of N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide?
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide has a molecular weight of 251.39 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2,3-dimethylbutan-2-yl)-3-methylbutane-1-sulfonamide is sourced from PubChem (CID 103931309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).