(2R)-2-(dimethylsulfamoylamino)-3-methylbutane

C7H18N2O2S — CID 58679586

IUPAC(2R)-2-(dimethylsulfamoylamino)-3-methylbutane
SMILESCC(C)[C@@H](C)NS(=O)(=O)N(C)C
InChIInChI=1S/C7H18N2O2S/c1-6(2)7(3)8-12(10,11)9(4)5/h6-8H,1-5H3/t7-/m1/s1
InChIKeyABECMIFKKRRPQR-SSDOTTSWSA-N
MW194.30 g/mol
LogP0.43
Rot. Bonds4

About (2R)-2-(dimethylsulfamoylamino)-3-methylbutane

(2R)-2-(dimethylsulfamoylamino)-3-methylbutane (PubChem CID 58679586) has the molecular formula C7H18N2O2S and a molecular weight of 194.30 g/mol. Its IUPAC name is (2R)-2-(dimethylsulfamoylamino)-3-methylbutane.

Molecular Properties

Compound Name(2R)-2-(dimethylsulfamoylamino)-3-methylbutane
PubChem CID58679586
Molecular FormulaC7H18N2O2S
Molecular Weight194.30 g/mol
Exact Mass194.11
IUPAC Name(2R)-2-(dimethylsulfamoylamino)-3-methylbutane
SMILESCC(C)[C@@H](C)NS(=O)(=O)N(C)C
InChIInChI=1S/C7H18N2O2S/c1-6(2)7(3)8-12(10,11)9(4)5/h6-8H,1-5H3/t7-/m1/s1
InChIKeyABECMIFKKRRPQR-SSDOTTSWSA-N
XLogP0.43
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylsulfamoylamino)-3-methylbutane?
The IUPAC name of (2R)-2-(dimethylsulfamoylamino)-3-methylbutane (CID 58679586) is (2R)-2-(dimethylsulfamoylamino)-3-methylbutane.
What is the SMILES notation for (2R)-2-(dimethylsulfamoylamino)-3-methylbutane?
The canonical SMILES for (2R)-2-(dimethylsulfamoylamino)-3-methylbutane is CC(C)[C@@H](C)NS(=O)(=O)N(C)C.
What is the InChIKey of (2R)-2-(dimethylsulfamoylamino)-3-methylbutane?
The InChIKey is ABECMIFKKRRPQR-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H18N2O2S/c1-6(2)7(3)8-12(10,11)9(4)5/h6-8H,1-5H3/t7-/m1/s1.
What are the key properties of (2R)-2-(dimethylsulfamoylamino)-3-methylbutane?
(2R)-2-(dimethylsulfamoylamino)-3-methylbutane has a molecular weight of 194.30 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylsulfamoylamino)-3-methylbutane is sourced from PubChem (CID 58679586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).