2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane

C11H26N2O3S — CID 113318152

IUPAC2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
SMILESCC(C)N(C)S(=O)(=O)NCC(O)CC(C)(C)C
InChIInChI=1S/C11H26N2O3S/c1-9(2)13(6)17(15,16)12-8-10(14)7-11(3,4)5/h9-10,12,14H,7-8H2,1-6H3
InChIKeyLMBSJOBAKBWYBU-UHFFFAOYSA-N
MW266.41 g/mol
LogP0.96
Rot. Bonds6

About 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane

2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane (PubChem CID 113318152) has the molecular formula C11H26N2O3S and a molecular weight of 266.41 g/mol. Its IUPAC name is 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane.

Molecular Properties

Compound Name2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
PubChem CID113318152
Molecular FormulaC11H26N2O3S
Molecular Weight266.41 g/mol
Exact Mass266.17
IUPAC Name2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane
SMILESCC(C)N(C)S(=O)(=O)NCC(O)CC(C)(C)C
InChIInChI=1S/C11H26N2O3S/c1-9(2)13(6)17(15,16)12-8-10(14)7-11(3,4)5/h9-10,12,14H,7-8H2,1-6H3
InChIKeyLMBSJOBAKBWYBU-UHFFFAOYSA-N
XLogP0.96
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The IUPAC name of 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane (CID 113318152) is 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane.
What is the SMILES notation for 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The canonical SMILES for 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane is CC(C)N(C)S(=O)(=O)NCC(O)CC(C)(C)C.
What is the InChIKey of 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
The InChIKey is LMBSJOBAKBWYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3S/c1-9(2)13(6)17(15,16)12-8-10(14)7-11(3,4)5/h9-10,12,14H,7-8H2,1-6H3.
What are the key properties of 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane?
2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane has a molecular weight of 266.41 g/mol, XLogP of 0.96, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-4,4-dimethyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]pentane is sourced from PubChem (CID 113318152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).