3-methyl-1-methylsulfonylpiperidin-4-amine

C7H16N2O2S — CID 67385582

IUPAC3-methyl-1-methylsulfonylpiperidin-4-amine
SMILESCC1CN(S(C)(=O)=O)CCC1N
InChIInChI=1S/C7H16N2O2S/c1-6-5-9(12(2,10)11)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3
InChIKeyFRNHPJXWQSBQMR-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.38
Rot. Bonds1

About 3-methyl-1-methylsulfonylpiperidin-4-amine

3-methyl-1-methylsulfonylpiperidin-4-amine (PubChem CID 67385582) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is 3-methyl-1-methylsulfonylpiperidin-4-amine.

Molecular Properties

Compound Name3-methyl-1-methylsulfonylpiperidin-4-amine
PubChem CID67385582
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name3-methyl-1-methylsulfonylpiperidin-4-amine
SMILESCC1CN(S(C)(=O)=O)CCC1N
InChIInChI=1S/C7H16N2O2S/c1-6-5-9(12(2,10)11)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3
InChIKeyFRNHPJXWQSBQMR-UHFFFAOYSA-N
XLogP-0.38
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4R)-3-fluoro-1-methylsulfonylpiperidin-4-amine
CID 171582016
1-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methylpiperidin-4-amine;hydrochloride
CID 119984041
(3S)-1-methylsulfonylpyrrolidin-3-amine;hydrochloride
CID 66672546
N,3-dimethyl-1-methylsulfonylpiperidin-4-amine
CID 114449186
4-amino-3-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 114813739
2-(4-amino-3-methylpiperidin-1-yl)-1-(4-methylsulfonylpiperazin-1-yl)ethanone
CID 79874632
4-methyl-1-(4-methylpiperidin-1-yl)sulfonylpyrrolidin-3-amine;hydrochloride
CID 120585482
3-methyl-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidin-4-amine;hydrochloride
CID 119984054
1-methylsulfonylpyrrolidin-3-ol
CID 20745843
(3R)-1-methylsulfonylpyrrolidin-3-ol
CID 78998740
1-(2,4-dimethylphenyl)sulfonyl-3-methylpiperidin-4-amine
CID 79867451
(3R,4S)-3,4-dimethylpiperidine-1-sulfonamide
CID 45080623

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-methylsulfonylpiperidin-4-amine?
The IUPAC name of 3-methyl-1-methylsulfonylpiperidin-4-amine (CID 67385582) is 3-methyl-1-methylsulfonylpiperidin-4-amine.
What is the SMILES notation for 3-methyl-1-methylsulfonylpiperidin-4-amine?
The canonical SMILES for 3-methyl-1-methylsulfonylpiperidin-4-amine is CC1CN(S(C)(=O)=O)CCC1N.
What is the InChIKey of 3-methyl-1-methylsulfonylpiperidin-4-amine?
The InChIKey is FRNHPJXWQSBQMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-6-5-9(12(2,10)11)4-3-7(6)8/h6-7H,3-5,8H2,1-2H3.
What are the key properties of 3-methyl-1-methylsulfonylpiperidin-4-amine?
3-methyl-1-methylsulfonylpiperidin-4-amine has a molecular weight of 192.28 g/mol, XLogP of -0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-methylsulfonylpiperidin-4-amine is sourced from PubChem (CID 67385582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).