2-amino-N-(cyclopropylmethyl)ethanesulfonamide

C6H14N2O2S — CID 16791531

IUPAC2-amino-N-(cyclopropylmethyl)ethanesulfonamide
SMILESNCCS(=O)(=O)NCC1CC1
InChIInChI=1S/C6H14N2O2S/c7-3-4-11(9,10)8-5-6-1-2-6/h6,8H,1-5,7H2
InChIKeyOQJJJJOZOUZEOV-UHFFFAOYSA-N
MW178.26 g/mol
LogP-0.73
Rot. Bonds5

About 2-amino-N-(cyclopropylmethyl)ethanesulfonamide

2-amino-N-(cyclopropylmethyl)ethanesulfonamide (PubChem CID 16791531) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is 2-amino-N-(cyclopropylmethyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(cyclopropylmethyl)ethanesulfonamide
PubChem CID16791531
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC Name2-amino-N-(cyclopropylmethyl)ethanesulfonamide
SMILESNCCS(=O)(=O)NCC1CC1
InChIInChI=1S/C6H14N2O2S/c7-3-4-11(9,10)8-5-6-1-2-6/h6,8H,1-5,7H2
InChIKeyOQJJJJOZOUZEOV-UHFFFAOYSA-N
XLogP-0.73
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methylbutane-1-sulfonamide
CID 61456555
4-Aminobutane-1-sulfonamide hydrochloride
CID 119032131
1-(Aminomethyl)cyclopropane-1-sulfonamide hydrochloride
CID 126841175
N-(2-aminoethyl)cyclopropanesulfonamide hydrochloride
CID 137919876
N-(3-aminopropyl)cyclopropanesulfonamide hydrochloride
CID 137919891
[1-(Aminomethyl)cyclopropyl]methanesulfonamide hydrochloride
CID 170918629
2-amino-N-cyclopropylethane-1-sulfonamide
CID 16787497
N-(2-aminoethyl)cyclopropanesulfonamide
CID 64553228
1-(Aminomethyl)cyclopropane-1-sulfonamide
CID 126841176
N-(3-aminopropyl)cyclopropanesulfonamide
CID 64553015
N-(2-methylpropyl)ethanesulfonamide
CID 5159392
4-Aminobutane-1-sulfonamide
CID 11550042

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclopropylmethyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-(cyclopropylmethyl)ethanesulfonamide (CID 16791531) is 2-amino-N-(cyclopropylmethyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-(cyclopropylmethyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-(cyclopropylmethyl)ethanesulfonamide is NCCS(=O)(=O)NCC1CC1.
What is the InChIKey of 2-amino-N-(cyclopropylmethyl)ethanesulfonamide?
The InChIKey is OQJJJJOZOUZEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S/c7-3-4-11(9,10)8-5-6-1-2-6/h6,8H,1-5,7H2.
What are the key properties of 2-amino-N-(cyclopropylmethyl)ethanesulfonamide?
2-amino-N-(cyclopropylmethyl)ethanesulfonamide has a molecular weight of 178.26 g/mol, XLogP of -0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclopropylmethyl)ethanesulfonamide is sourced from PubChem (CID 16791531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).