2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine

C14H32N2O2S — CID 23323940

IUPAC2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine
SMILESCC(CNS(=O)(=O)NCC(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H32N2O2S/c1-11(13(3,4)5)9-15-19(17,18)16-10-12(2)14(6,7)8/h11-12,15-16H,9-10H2,1-8H3
InChIKeyYTWGFXGBWHEELN-UHFFFAOYSA-N
MW292.49 g/mol
LogP2.77
Rot. Bonds6

About 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine

2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine (PubChem CID 23323940) has the molecular formula C14H32N2O2S and a molecular weight of 292.49 g/mol. Its IUPAC name is 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine.

Molecular Properties

Compound Name2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine
PubChem CID23323940
Molecular FormulaC14H32N2O2S
Molecular Weight292.49 g/mol
Exact Mass292.22
IUPAC Name2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine
SMILESCC(CNS(=O)(=O)NCC(C)C(C)(C)C)C(C)(C)C
InChIInChI=1S/C14H32N2O2S/c1-11(13(3,4)5)9-15-19(17,18)16-10-12(2)14(6,7)8/h11-12,15-16H,9-10H2,1-8H3
InChIKeyYTWGFXGBWHEELN-UHFFFAOYSA-N
XLogP2.77
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.49
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine?
The IUPAC name of 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine (CID 23323940) is 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine.
What is the SMILES notation for 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine?
The canonical SMILES for 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine is CC(CNS(=O)(=O)NCC(C)C(C)(C)C)C(C)(C)C.
What is the InChIKey of 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine?
The InChIKey is YTWGFXGBWHEELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O2S/c1-11(13(3,4)5)9-15-19(17,18)16-10-12(2)14(6,7)8/h11-12,15-16H,9-10H2,1-8H3.
What are the key properties of 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine?
2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine has a molecular weight of 292.49 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethyl-N-(2,3,3-trimethylbutylsulfamoyl)butan-1-amine is sourced from PubChem (CID 23323940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).