(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine

C10H25N3O2S — CID 89072419

IUPAC(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine
SMILESCN[C@H](CN(C)S(=O)(=O)N(C)C)C(C)(C)C
InChIInChI=1S/C10H25N3O2S/c1-10(2,3)9(11-4)8-13(7)16(14,15)12(5)6/h9,11H,8H2,1-7H3/t9-/m1/s1
InChIKeySVWMMHXCWWRHAW-SECBINFHSA-N
MW251.40 g/mol
LogP0.36
Rot. Bonds5

About (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine

(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine (PubChem CID 89072419) has the molecular formula C10H25N3O2S and a molecular weight of 251.40 g/mol. Its IUPAC name is (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine.

Molecular Properties

Compound Name(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine
PubChem CID89072419
Molecular FormulaC10H25N3O2S
Molecular Weight251.40 g/mol
Exact Mass251.17
IUPAC Name(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine
SMILESCN[C@H](CN(C)S(=O)(=O)N(C)C)C(C)(C)C
InChIInChI=1S/C10H25N3O2S/c1-10(2,3)9(11-4)8-13(7)16(14,15)12(5)6/h9,11H,8H2,1-7H3/t9-/m1/s1
InChIKeySVWMMHXCWWRHAW-SECBINFHSA-N
XLogP0.36
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine?
The IUPAC name of (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine (CID 89072419) is (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine.
What is the SMILES notation for (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine?
The canonical SMILES for (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine is CN[C@H](CN(C)S(=O)(=O)N(C)C)C(C)(C)C.
What is the InChIKey of (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine?
The InChIKey is SVWMMHXCWWRHAW-SECBINFHSA-N. The full InChI is InChI=1S/C10H25N3O2S/c1-10(2,3)9(11-4)8-13(7)16(14,15)12(5)6/h9,11H,8H2,1-7H3/t9-/m1/s1.
What are the key properties of (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine?
(2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine has a molecular weight of 251.40 g/mol, XLogP of 0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-N-(dimethylsulfamoyl)-1-N,2-N,3,3-tetramethylbutane-1,2-diamine is sourced from PubChem (CID 89072419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).