2-(sulfamoylamino)butane

C4H12N2O2S — CID 22273082

IUPAC2-(sulfamoylamino)butane
SMILESCCC(C)NS(N)(=O)=O
InChIInChI=1S/C4H12N2O2S/c1-3-4(2)6-9(5,7)8/h4,6H,3H2,1-2H3,(H2,5,7,8)
InChIKeyRPHJRFARHWCOBN-UHFFFAOYSA-N
MW152.22 g/mol
LogP-0.42
Rot. Bonds3

About 2-(sulfamoylamino)butane

2-(sulfamoylamino)butane (PubChem CID 22273082) has the molecular formula C4H12N2O2S and a molecular weight of 152.22 g/mol. Its IUPAC name is 2-(sulfamoylamino)butane.

Molecular Properties

Compound Name2-(sulfamoylamino)butane
PubChem CID22273082
Molecular FormulaC4H12N2O2S
Molecular Weight152.22 g/mol
Exact Mass152.06
IUPAC Name2-(sulfamoylamino)butane
SMILESCCC(C)NS(N)(=O)=O
InChIInChI=1S/C4H12N2O2S/c1-3-4(2)6-9(5,7)8/h4,6H,3H2,1-2H3,(H2,5,7,8)
InChIKeyRPHJRFARHWCOBN-UHFFFAOYSA-N
XLogP-0.42
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.22
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Isopropylsulphamoyl chloride
CID 117737
N-butylsulfamide
CID 12355589
N,N''''-Dipropylsulfamide
CID 15729847
Isopropylsulfamic acid
CID 65283
Sulfamoyl azide, isopropyl-
CID 214664
N-(1-Methylethyl)sulfamide
CID 13626285
n-Propylsulfamide
CID 13949558
(Ethylsulfamoyl)amine
CID 21263690
N,N'-Diethylsulfamide
CID 219236
Bis(isopropylammonium) sulphate
CID 6454858
N-cyclopropylaminosulfonamide
CID 21041394
(Cyclopropylsulfamoyl)(methyl)amine
CID 70271030

Frequently Asked Questions

What is the IUPAC name of 2-(sulfamoylamino)butane?
The IUPAC name of 2-(sulfamoylamino)butane (CID 22273082) is 2-(sulfamoylamino)butane.
What is the SMILES notation for 2-(sulfamoylamino)butane?
The canonical SMILES for 2-(sulfamoylamino)butane is CCC(C)NS(N)(=O)=O.
What is the InChIKey of 2-(sulfamoylamino)butane?
The InChIKey is RPHJRFARHWCOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2O2S/c1-3-4(2)6-9(5,7)8/h4,6H,3H2,1-2H3,(H2,5,7,8).
What are the key properties of 2-(sulfamoylamino)butane?
2-(sulfamoylamino)butane has a molecular weight of 152.22 g/mol, XLogP of -0.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(sulfamoylamino)butane is sourced from PubChem (CID 22273082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).