(2R)-2-(dimethylsulfamoylamino)-4-methylpentane

C8H20N2O2S — CID 58923230

IUPAC(2R)-2-(dimethylsulfamoylamino)-4-methylpentane
SMILESCC(C)C[C@@H](C)NS(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O2S/c1-7(2)6-8(3)9-13(11,12)10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1
InChIKeyBQCTVSLZKDMYDO-MRVPVSSYSA-N
MW208.33 g/mol
LogP0.82
Rot. Bonds5

About (2R)-2-(dimethylsulfamoylamino)-4-methylpentane

(2R)-2-(dimethylsulfamoylamino)-4-methylpentane (PubChem CID 58923230) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is (2R)-2-(dimethylsulfamoylamino)-4-methylpentane.

Molecular Properties

Compound Name(2R)-2-(dimethylsulfamoylamino)-4-methylpentane
PubChem CID58923230
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC Name(2R)-2-(dimethylsulfamoylamino)-4-methylpentane
SMILESCC(C)C[C@@H](C)NS(=O)(=O)N(C)C
InChIInChI=1S/C8H20N2O2S/c1-7(2)6-8(3)9-13(11,12)10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1
InChIKeyBQCTVSLZKDMYDO-MRVPVSSYSA-N
XLogP0.82
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(dimethylsulfamoylamino)-4-methylpentane?
The IUPAC name of (2R)-2-(dimethylsulfamoylamino)-4-methylpentane (CID 58923230) is (2R)-2-(dimethylsulfamoylamino)-4-methylpentane.
What is the SMILES notation for (2R)-2-(dimethylsulfamoylamino)-4-methylpentane?
The canonical SMILES for (2R)-2-(dimethylsulfamoylamino)-4-methylpentane is CC(C)C[C@@H](C)NS(=O)(=O)N(C)C.
What is the InChIKey of (2R)-2-(dimethylsulfamoylamino)-4-methylpentane?
The InChIKey is BQCTVSLZKDMYDO-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-7(2)6-8(3)9-13(11,12)10(4)5/h7-9H,6H2,1-5H3/t8-/m1/s1.
What are the key properties of (2R)-2-(dimethylsulfamoylamino)-4-methylpentane?
(2R)-2-(dimethylsulfamoylamino)-4-methylpentane has a molecular weight of 208.33 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(dimethylsulfamoylamino)-4-methylpentane is sourced from PubChem (CID 58923230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).