1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane

C8H20N2O3S — CID 103835334

IUPAC1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane
SMILESCCCC(C)(O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O3S/c1-5-6-8(2,11)7-9-14(12,13)10(3)4/h9,11H,5-7H2,1-4H3
InChIKeyLDXCFUGJTCLJEK-UHFFFAOYSA-N
MW224.33 g/mol
LogP-0.07
Rot. Bonds6

About 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane

1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane (PubChem CID 103835334) has the molecular formula C8H20N2O3S and a molecular weight of 224.33 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane
PubChem CID103835334
Molecular FormulaC8H20N2O3S
Molecular Weight224.33 g/mol
Exact Mass224.12
IUPAC Name1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane
SMILESCCCC(C)(O)CNS(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O3S/c1-5-6-8(2,11)7-9-14(12,13)10(3)4/h9,11H,5-7H2,1-4H3
InChIKeyLDXCFUGJTCLJEK-UHFFFAOYSA-N
XLogP-0.07
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane?
The IUPAC name of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane (CID 103835334) is 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane?
The canonical SMILES for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane is CCCC(C)(O)CNS(=O)(=O)N(C)C.
What is the InChIKey of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane?
The InChIKey is LDXCFUGJTCLJEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O3S/c1-5-6-8(2,11)7-9-14(12,13)10(3)4/h9,11H,5-7H2,1-4H3.
What are the key properties of 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane?
1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane has a molecular weight of 224.33 g/mol, XLogP of -0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-2-hydroxy-2-methylpentane is sourced from PubChem (CID 103835334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).