methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine

C9H24N2O2S — CID 160582271

IUPACmethane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
SMILESC.CC(C)CCNS(=O)(=O)NC(C)C
InChIInChI=1S/C8H20N2O2S.CH4/c1-7(2)5-6-9-13(11,12)10-8(3)4;/h7-10H,5-6H2,1-4H3;1H4
InChIKeyRBXYYAAEHMYIOB-UHFFFAOYSA-N
MW224.37 g/mol
LogP1.50
Rot. Bonds6

About methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine

methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine (PubChem CID 160582271) has the molecular formula C9H24N2O2S and a molecular weight of 224.37 g/mol. Its IUPAC name is methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine.

Molecular Properties

Compound Namemethane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
PubChem CID160582271
Molecular FormulaC9H24N2O2S
Molecular Weight224.37 g/mol
Exact Mass224.16
IUPAC Namemethane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
SMILESC.CC(C)CCNS(=O)(=O)NC(C)C
InChIInChI=1S/C8H20N2O2S.CH4/c1-7(2)5-6-9-13(11,12)10-8(3)4;/h7-10H,5-6H2,1-4H3;1H4
InChIKeyRBXYYAAEHMYIOB-UHFFFAOYSA-N
XLogP1.50
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-Bis(2-methylpropyl)sulfamide
CID 100954722
3-methyl-N-(3-methylbutylsulfamoyl)butan-1-amine
CID 102243142
1,1,1-trifluoro-3-methyl-N-(2-methylpropylsulfamoyl)butan-2-amine
CID 140915623
2-methyl-N-(propan-2-ylsulfamoyl)butan-2-amine
CID 131863190
N-(butan-2-ylsulfamoyl)butan-2-amine
CID 134897087
Bis(3-methylbutylazanium);sulfate
CID 20836350
3-Methyl-1-(sulfamoylamino)butane
CID 21345371
2-methyl-N-(propan-2-ylsulfamoyl)propan-1-amine
CID 22966183
3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine
CID 22966184
4-methyl-N-(propan-2-ylsulfamoyl)pentan-1-amine
CID 22966185
2-methyl-N-(propan-2-ylsulfamoyl)propan-2-amine
CID 57741188
(2R)-2-(dimethylsulfamoylamino)-3-methylbutane
CID 58679586

Frequently Asked Questions

What is the IUPAC name of methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine?
The IUPAC name of methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine (CID 160582271) is methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine.
What is the SMILES notation for methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine?
The canonical SMILES for methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine is C.CC(C)CCNS(=O)(=O)NC(C)C.
What is the InChIKey of methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine?
The InChIKey is RBXYYAAEHMYIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2S.CH4/c1-7(2)5-6-9-13(11,12)10-8(3)4;/h7-10H,5-6H2,1-4H3;1H4.
What are the key properties of methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine?
methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine has a molecular weight of 224.37 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methane;3-methyl-N-(propan-2-ylsulfamoyl)butan-1-amine is sourced from PubChem (CID 160582271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).