N-(2-methylpropylsulfamoyl)butan-2-amine

C8H20N2O2S — CID 114814896

IUPACN-(2-methylpropylsulfamoyl)butan-2-amine
SMILESCCC(C)NS(=O)(=O)NCC(C)C
InChIInChI=1S/C8H20N2O2S/c1-5-8(4)10-13(11,12)9-6-7(2)3/h7-10H,5-6H2,1-4H3
InChIKeyZRDWYZKXVJNHFW-UHFFFAOYSA-N
MW208.33 g/mol
LogP0.86
Rot. Bonds6

About N-(2-methylpropylsulfamoyl)butan-2-amine

N-(2-methylpropylsulfamoyl)butan-2-amine (PubChem CID 114814896) has the molecular formula C8H20N2O2S and a molecular weight of 208.33 g/mol. Its IUPAC name is N-(2-methylpropylsulfamoyl)butan-2-amine.

Molecular Properties

Compound NameN-(2-methylpropylsulfamoyl)butan-2-amine
PubChem CID114814896
Molecular FormulaC8H20N2O2S
Molecular Weight208.33 g/mol
Exact Mass208.12
IUPAC NameN-(2-methylpropylsulfamoyl)butan-2-amine
SMILESCCC(C)NS(=O)(=O)NCC(C)C
InChIInChI=1S/C8H20N2O2S/c1-5-8(4)10-13(11,12)9-6-7(2)3/h7-10H,5-6H2,1-4H3
InChIKeyZRDWYZKXVJNHFW-UHFFFAOYSA-N
XLogP0.86
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
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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Related Compounds

(2S,3S)-3-methyl-2-(2-methylpropylsulfamoylamino)pentanoic acid
CID 104978587
N-(ethoxysulfamoyl)-2-methylpropan-1-amine
CID 114814909
3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
CID 106288332
N-butan-2-ylethanesulfonamide
CID 5091177
N-(butan-2-ylsulfamoyl)cyclopropanamine
CID 114383068
N-butan-2-ylsulfamoyl fluoride
CID 56606599
N-(tert-butylsulfamoyl)-2-methylpropan-1-amine
CID 104538392
4-[1-(2-methylpropylsulfamoylamino)ethyl]benzenesulfonamide
CID 114816628
2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol
CID 114815684
N-butan-2-yl-3-methylbutane-1-sulfonamide
CID 63373512
3-methoxy-2-(2-methylpropylsulfamoylamino)propan-1-ol
CID 106184934
N-(2-methylpropyl)sulfamate
CID 59847903

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropylsulfamoyl)butan-2-amine?
The IUPAC name of N-(2-methylpropylsulfamoyl)butan-2-amine (CID 114814896) is N-(2-methylpropylsulfamoyl)butan-2-amine.
What is the SMILES notation for N-(2-methylpropylsulfamoyl)butan-2-amine?
The canonical SMILES for N-(2-methylpropylsulfamoyl)butan-2-amine is CCC(C)NS(=O)(=O)NCC(C)C.
What is the InChIKey of N-(2-methylpropylsulfamoyl)butan-2-amine?
The InChIKey is ZRDWYZKXVJNHFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S/c1-5-8(4)10-13(11,12)9-6-7(2)3/h7-10H,5-6H2,1-4H3.
What are the key properties of N-(2-methylpropylsulfamoyl)butan-2-amine?
N-(2-methylpropylsulfamoyl)butan-2-amine has a molecular weight of 208.33 g/mol, XLogP of 0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropylsulfamoyl)butan-2-amine is sourced from PubChem (CID 114814896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).