(1-methylsulfonylcyclopentyl)methanamine;hydrochloride

C7H16ClNO2S — CID 119031260

IUPAC(1-methylsulfonylcyclopentyl)methanamine;hydrochloride
SMILESCS(=O)(=O)C1(CN)CCCC1.Cl
InChIInChI=1S/C7H15NO2S.ClH/c1-11(9,10)7(6-8)4-2-3-5-7;/h2-6,8H2,1H3;1H
InChIKeyHSFAKONRKGTTPI-UHFFFAOYSA-N
MW213.73 g/mol
LogP0.72
Rot. Bonds2

About (1-methylsulfonylcyclopentyl)methanamine;hydrochloride

(1-methylsulfonylcyclopentyl)methanamine;hydrochloride (PubChem CID 119031260) has the molecular formula C7H16ClNO2S and a molecular weight of 213.73 g/mol. Its IUPAC name is (1-methylsulfonylcyclopentyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(1-methylsulfonylcyclopentyl)methanamine;hydrochloride
PubChem CID119031260
Molecular FormulaC7H16ClNO2S
Molecular Weight213.73 g/mol
Exact Mass213.06
IUPAC Name(1-methylsulfonylcyclopentyl)methanamine;hydrochloride
SMILESCS(=O)(=O)C1(CN)CCCC1.Cl
InChIInChI=1S/C7H15NO2S.ClH/c1-11(9,10)7(6-8)4-2-3-5-7;/h2-6,8H2,1H3;1H
InChIKeyHSFAKONRKGTTPI-UHFFFAOYSA-N
XLogP0.72
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.73
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-ethylsulfonylcyclopropyl)methanamine;hydrochloride
CID 122164381
2-(1-methylsulfonylcyclobutyl)acetaldehyde
CID 158561521
N-[(1-methylsulfonylcyclopentyl)methyl]cyclopropanamine
CID 62596755
(1-benzyl-4-methylsulfonylpiperidin-4-yl)methanamine
CID 99997092
1-methylsulfonylcycloheptan-1-amine
CID 62473091
1-cyclobutyl-2-[(1-methylsulfonylcyclopentyl)methyl]guanidine
CID 122096093
2-methoxy-N-[(1-methylsulfonylcyclohexyl)methyl]ethanamine
CID 62594737
N'-[(1-methylsulfonylcyclopentyl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 120973772
[1-(2-bromophenyl)sulfonylcyclopentyl]methanamine
CID 90313478
[1-(4-ethylphenyl)sulfonylcyclobutyl]methanamine
CID 117032316
1-methylsulfonylcyclohexan-1-ol
CID 91081650
1-[1-(aminomethyl)cyclopentyl]ethanone;hydrochloride
CID 86775853

Frequently Asked Questions

What is the IUPAC name of (1-methylsulfonylcyclopentyl)methanamine;hydrochloride?
The IUPAC name of (1-methylsulfonylcyclopentyl)methanamine;hydrochloride (CID 119031260) is (1-methylsulfonylcyclopentyl)methanamine;hydrochloride.
What is the SMILES notation for (1-methylsulfonylcyclopentyl)methanamine;hydrochloride?
The canonical SMILES for (1-methylsulfonylcyclopentyl)methanamine;hydrochloride is CS(=O)(=O)C1(CN)CCCC1.Cl.
What is the InChIKey of (1-methylsulfonylcyclopentyl)methanamine;hydrochloride?
The InChIKey is HSFAKONRKGTTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2S.ClH/c1-11(9,10)7(6-8)4-2-3-5-7;/h2-6,8H2,1H3;1H.
What are the key properties of (1-methylsulfonylcyclopentyl)methanamine;hydrochloride?
(1-methylsulfonylcyclopentyl)methanamine;hydrochloride has a molecular weight of 213.73 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylsulfonylcyclopentyl)methanamine;hydrochloride is sourced from PubChem (CID 119031260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).