N-(2-amino-2-methylpropyl)butane-1-sulfonamide

C8H20N2O2S — CID 115303565

IUPACN-(2-amino-2-methylpropyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(C)(C)N
InChIInChI=1S/C8H20N2O2S/c1-4-5-6-13(11,12)10-7-8(2,3)9/h10H,4-7,9H2,1-3H3
InChIKeyVIBMLJNWBKVDHO-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.44
Rot. Bonds6

About N-(2-amino-2-methylpropyl)butane-1-sulfonamide

N-(2-amino-2-methylpropyl)butane-1-sulfonamide (PubChem CID 115303565) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is N-(2-amino-2-methylpropyl)butane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-amino-2-methylpropyl)butane-1-sulfonamide
PubChem CID115303565
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN-(2-amino-2-methylpropyl)butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(C)(C)N
InChIInChI=1S/C8H20N2O2S/c1-4-5-6-13(11,12)10-7-8(2,3)9/h10H,4-7,9H2,1-3H3
InChIKeyVIBMLJNWBKVDHO-UHFFFAOYSA-N
XLogP0.44
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.33
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-methylpropyl)-3-methoxypropane-1-sulfonamide
CID 115303463
N-(2-amino-2-methylpropyl)ethanesulfonamide
CID 115303418
methyl 4-[(2-amino-2-methylpropyl)sulfamoyl]butanoate
CID 115303566
N-(2-hydroxy-2,4-dimethylpentyl)butane-1-sulfonamide
CID 66180381
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)butane-1-sulfonamide
CID 90523075
N-(2-sulfamoylethyl)butane-1-sulfonamide
CID 61131734
N-methylbutane-1-sulfonamide;hydrochloride
CID 141278218
N-(2,2-dimethylbutyl)propane-1-sulfonamide
CID 103465142
N-decylbutane-1-sulfonamide
CID 19681427
N-(2-hydroxy-2-thiophen-2-ylpropyl)butane-1-sulfonamide
CID 71782464
N-(2-amino-2-methylpropyl)-3-(1,3-dioxoisoindol-2-yl)propane-1-sulfonamide
CID 120711592
N-[2-(propylamino)ethyl]butane-1-sulfonamide
CID 62663882

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-methylpropyl)butane-1-sulfonamide?
The IUPAC name of N-(2-amino-2-methylpropyl)butane-1-sulfonamide (CID 115303565) is N-(2-amino-2-methylpropyl)butane-1-sulfonamide.
What is the SMILES notation for N-(2-amino-2-methylpropyl)butane-1-sulfonamide?
The canonical SMILES for N-(2-amino-2-methylpropyl)butane-1-sulfonamide is CCCCS(=O)(=O)NCC(C)(C)N.
What is the InChIKey of N-(2-amino-2-methylpropyl)butane-1-sulfonamide?
The InChIKey is VIBMLJNWBKVDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-4-5-6-13(11,12)10-7-8(2,3)9/h10H,4-7,9H2,1-3H3.
What are the key properties of N-(2-amino-2-methylpropyl)butane-1-sulfonamide?
N-(2-amino-2-methylpropyl)butane-1-sulfonamide has a molecular weight of 208.33 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-methylpropyl)butane-1-sulfonamide is sourced from PubChem (CID 115303565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).