[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride

C6H15ClN2O2S — CID 167722351

IUPAC[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride
SMILESCl.NCC1(CS(N)(=O)=O)CCC1
InChIInChI=1S/C6H14N2O2S.ClH/c7-4-6(2-1-3-6)5-11(8,9)10;/h1-5,7H2,(H2,8,9,10);1H
InChIKeyIIDRRSODNNACMP-UHFFFAOYSA-N
MW214.72 g/mol
LogP-0.17
Rot. Bonds3

About [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride

[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride (PubChem CID 167722351) has the molecular formula C6H15ClN2O2S and a molecular weight of 214.72 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride
PubChem CID167722351
Molecular FormulaC6H15ClN2O2S
Molecular Weight214.72 g/mol
Exact Mass214.05
IUPAC Name[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride
SMILESCl.NCC1(CS(N)(=O)=O)CCC1
InChIInChI=1S/C6H14N2O2S.ClH/c7-4-6(2-1-3-6)5-11(8,9)10;/h1-5,7H2,(H2,8,9,10);1H
InChIKeyIIDRRSODNNACMP-UHFFFAOYSA-N
XLogP-0.17
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.72
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1-propylcyclopropyl)methanesulfonamide
CID 130554026
[1-(cyclobutyloxymethyl)cyclopentyl]methanesulfonamide
CID 65003105
[1-(cycloheptyloxymethyl)cycloheptyl]methanesulfonamide
CID 65010094
[1-(2-methoxyethoxymethyl)cycloheptyl]methanesulfonamide
CID 65010433
[1-(2,2-difluoroethoxymethyl)cyclohexyl]methanesulfonamide
CID 82010399
[1-(2,2,2-trifluoroethoxymethyl)cyclohexyl]methanesulfonamide
CID 65006896
[1-[(2,6-dimethylphenoxy)methyl]cyclopentyl]methanesulfonamide
CID 65003339
[1-[(2,6-difluorophenoxy)methyl]cyclohexyl]methanesulfonamide
CID 81265285
4-[2-[1-(aminomethyl)cyclobutyl]acetyl]piperazine-1-sulfonamide
CID 81172470
[1-(cyclohexylmethoxymethyl)cycloheptyl]methanesulfonamide
CID 65009994
[1-(fluoromethyl)cyclopentyl]methanamine;hydrochloride
CID 105433644
[1-(phenoxymethyl)cyclohexyl]methanesulfonamide
CID 65006602

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride?
The IUPAC name of [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride (CID 167722351) is [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride is Cl.NCC1(CS(N)(=O)=O)CCC1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride?
The InChIKey is IIDRRSODNNACMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2S.ClH/c7-4-6(2-1-3-6)5-11(8,9)10;/h1-5,7H2,(H2,8,9,10);1H.
What are the key properties of [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride?
[1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride has a molecular weight of 214.72 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]methanesulfonamide;hydrochloride is sourced from PubChem (CID 167722351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).