N-(3-aminocyclobutyl)ethanesulfonamide

C6H14N2O2S — CID 43597857

IUPACN-(3-aminocyclobutyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CC(N)C1
InChIInChI=1S/C6H14N2O2S/c1-2-11(9,10)8-6-3-5(7)4-6/h5-6,8H,2-4,7H2,1H3
InChIKeyHHZPWNZYWOOSQB-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.58
Rot. Bonds3

About N-(3-aminocyclobutyl)ethanesulfonamide

N-(3-aminocyclobutyl)ethanesulfonamide (PubChem CID 43597857) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is N-(3-aminocyclobutyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(3-aminocyclobutyl)ethanesulfonamide
PubChem CID43597857
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC NameN-(3-aminocyclobutyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC1CC(N)C1
InChIInChI=1S/C6H14N2O2S/c1-2-11(9,10)8-6-3-5(7)4-6/h5-6,8H,2-4,7H2,1H3
InChIKeyHHZPWNZYWOOSQB-UHFFFAOYSA-N
XLogP-0.58
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminocyclobutyl)butane-1-sulfonamide
CID 43597856
ethyl 2-[(3-aminocyclobutyl)sulfamoyl]acetate
CID 61457539
ethyl 3-[(3-aminocyclobutyl)sulfamoyl]propanoate
CID 61459369
N-(4-aminocyclohexyl)ethanesulfonamide;cyclohexane-1,4-diamine;ethanesulfonyl chloride;hydrochloride
CID 159955669
1-amino-3-(dipropylsulfamoylamino)cyclobutane
CID 43597733
N-(3,4-dimethylcyclohexyl)ethanesulfonamide
CID 64748802
N-(6-azabicyclo[3.2.1]octan-3-yl)ethanesulfonamide
CID 165463570
N-(3-aminocyclobutyl)-1,1,1-trifluoromethanesulfonamide
CID 43597810
N-(3-aminocyclobutyl)-1-(oxan-2-yl)methanesulfonamide;hydrochloride
CID 120663977
3-(ethylsulfonylamino)cyclopentane-1-carboxylic acid
CID 66032739
N-(1,1-dioxothian-4-yl)ethanesulfonamide
CID 64586482
N-(2-methyloxan-4-yl)ethanesulfonamide
CID 103887605

Frequently Asked Questions

What is the IUPAC name of N-(3-aminocyclobutyl)ethanesulfonamide?
The IUPAC name of N-(3-aminocyclobutyl)ethanesulfonamide (CID 43597857) is N-(3-aminocyclobutyl)ethanesulfonamide.
What is the SMILES notation for N-(3-aminocyclobutyl)ethanesulfonamide?
The canonical SMILES for N-(3-aminocyclobutyl)ethanesulfonamide is CCS(=O)(=O)NC1CC(N)C1.
What is the InChIKey of N-(3-aminocyclobutyl)ethanesulfonamide?
The InChIKey is HHZPWNZYWOOSQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-2-11(9,10)8-6-3-5(7)4-6/h5-6,8H,2-4,7H2,1H3.
What are the key properties of N-(3-aminocyclobutyl)ethanesulfonamide?
N-(3-aminocyclobutyl)ethanesulfonamide has a molecular weight of 178.26 g/mol, XLogP of -0.58, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminocyclobutyl)ethanesulfonamide is sourced from PubChem (CID 43597857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).