N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide

C6H14N2O2S — CID 128920902

IUPACN-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide
SMILESCC1(S(=O)(=O)NCCN)CC1
InChIInChI=1S/C6H14N2O2S/c1-6(2-3-6)11(9,10)8-5-4-7/h8H,2-5,7H2,1H3
InChIKeyKFEUJEHRHSDHHT-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.58
Rot. Bonds4

About N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide

N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide (PubChem CID 128920902) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide
PubChem CID128920902
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC NameN-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide
SMILESCC1(S(=O)(=O)NCCN)CC1
InChIInChI=1S/C6H14N2O2S/c1-6(2-3-6)11(9,10)8-5-4-7/h8H,2-5,7H2,1H3
InChIKeyKFEUJEHRHSDHHT-UHFFFAOYSA-N
XLogP-0.58
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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-cyclopropyl-2-methylpropane-2-sulfonamide
CID 57911016
1-(Aminomethyl)cyclopropane-1-sulfonamide hydrochloride
CID 126841175
N-(2-aminoethyl)cyclopropanesulfonamide hydrochloride
CID 137919876
N-(2-aminoethyl)cyclopropanesulfonamide
CID 64553228
1-(Aminomethyl)cyclopropane-1-sulfonamide
CID 126841176
N-(2-aminoethyl)propane-1-sulfonamide
CID 13030948
N-(2-aminoethyl)propane-2-sulfonamide
CID 13030949
1-Amino-2-methylpropane-2-sulfonamide
CID 17985986
Ethyl-tert-butyl-sulfonamide
CID 21703069
2-methyl-N-propylpropane-2-sulfonamide
CID 22364465
N-isobutylcyclopropanesulfonamide
CID 49670462
N,1-dimethylcyclopropane-1-sulfonamide
CID 57816705

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide?
The IUPAC name of N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide (CID 128920902) is N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide.
What is the SMILES notation for N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide?
The canonical SMILES for N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide is CC1(S(=O)(=O)NCCN)CC1.
What is the InChIKey of N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide?
The InChIKey is KFEUJEHRHSDHHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-6(2-3-6)11(9,10)8-5-4-7/h8H,2-5,7H2,1H3.
What are the key properties of N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide?
N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide has a molecular weight of 178.26 g/mol, XLogP of -0.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-methylcyclopropane-1-sulfonamide is sourced from PubChem (CID 128920902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).