2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine

C8H20N2O2S — CID 57355566

IUPAC2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine
SMILESCC(C)NS(=O)(=O)NCC(C)(C)C
InChIInChI=1S/C8H20N2O2S/c1-7(2)10-13(11,12)9-6-8(3,4)5/h7,9-10H,6H2,1-5H3
InChIKeyVQZWXQBIDHNREC-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.86
Rot. Bonds4

About 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine

2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine (PubChem CID 57355566) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine
PubChem CID57355566
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC Name2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine
SMILESCC(C)NS(=O)(=O)NCC(C)(C)C
InChIInChI=1S/C8H20N2O2S/c1-7(2)10-13(11,12)9-6-8(3,4)5/h7,9-10H,6H2,1-5H3
InChIKeyVQZWXQBIDHNREC-UHFFFAOYSA-N
XLogP0.86
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine (CID 57355566) is 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine is CC(C)NS(=O)(=O)NCC(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine?
The InChIKey is VQZWXQBIDHNREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-7(2)10-13(11,12)9-6-8(3,4)5/h7,9-10H,6H2,1-5H3.
What are the key properties of 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine?
2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine has a molecular weight of 208.33 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(propan-2-ylsulfamoyl)propan-1-amine is sourced from PubChem (CID 57355566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).