2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride

C7H17ClN2O2S — CID 54592680

IUPAC2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride
SMILESCl.NCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C7H16N2O2S.ClH/c8-4-5-12(10,11)9-6-7-2-1-3-7;/h7,9H,1-6,8H2;1H
InChIKeyHPPMSHXHBKJLAP-UHFFFAOYSA-N
MW228.74 g/mol
LogP0.09
Rot. Bonds5

About 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride

2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride (PubChem CID 54592680) has the molecular formula C7H17ClN2O2S and a molecular weight of 228.74 g/mol. Its IUPAC name is 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride
PubChem CID54592680
Molecular FormulaC7H17ClN2O2S
Molecular Weight228.74 g/mol
Exact Mass228.07
IUPAC Name2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride
SMILESCl.NCCS(=O)(=O)NCC1CCC1
InChIInChI=1S/C7H16N2O2S.ClH/c8-4-5-12(10,11)9-6-7-2-1-3-7;/h7,9H,1-6,8H2;1H
InChIKeyHPPMSHXHBKJLAP-UHFFFAOYSA-N
XLogP0.09
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.74
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Aminopentane-1-sulfonamide hydrochloride
CID 87224929
1-(Aminomethyl)cyclobutane-1-sulfonamide hydrochloride
CID 132312926
2-amino-N-(cyclobutylmethyl)ethane-1-sulfonamide
CID 43298721
2-amino-N-[(3,3-difluorocyclobutyl)methyl]ethanesulfonamide
CID 157027047
1-(Aminomethyl)cyclobutane-1-sulfonamide
CID 132312927
6-Aminohexane-1-sulfonamide hydrochloride
CID 24201112
2-amino-N-(2-methylbutyl)ethanesulfonamide
CID 22946836
N-(2-cyclobutylethyl)ethanesulfonamide
CID 53681763
N-(cyclobutylmethyl)ethanesulfonamide
CID 57257592
(3R)-4-amino-N,3-dimethylbutane-1-sulfonamide
CID 140518495
(2R)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride
CID 170163374
(2S)-1-amino-3-methylbutane-2-sulfonamide;hydrochloride
CID 170166483

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride?
The IUPAC name of 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride (CID 54592680) is 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride?
The canonical SMILES for 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride is Cl.NCCS(=O)(=O)NCC1CCC1.
What is the InChIKey of 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride?
The InChIKey is HPPMSHXHBKJLAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S.ClH/c8-4-5-12(10,11)9-6-7-2-1-3-7;/h7,9H,1-6,8H2;1H.
What are the key properties of 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride?
2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride has a molecular weight of 228.74 g/mol, XLogP of 0.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclobutylmethyl)ethanesulfonamide;hydrochloride is sourced from PubChem (CID 54592680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).