N-methyl-1-methylsulfonylpiperidin-4-amine

C7H16N2O2S — CID 18758393

IUPACN-methyl-1-methylsulfonylpiperidin-4-amine
SMILESCNC1CCN(S(C)(=O)=O)CC1
InChIInChI=1S/C7H16N2O2S/c1-8-7-3-5-9(6-4-7)12(2,10)11/h7-8H,3-6H2,1-2H3
InChIKeyVCBIBMMEIOUYBB-UHFFFAOYSA-N
MW192.28 g/mol
LogP-0.37
Rot. Bonds2

About N-methyl-1-methylsulfonylpiperidin-4-amine

N-methyl-1-methylsulfonylpiperidin-4-amine (PubChem CID 18758393) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-methyl-1-methylsulfonylpiperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-methylsulfonylpiperidin-4-amine
PubChem CID18758393
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-methyl-1-methylsulfonylpiperidin-4-amine
SMILESCNC1CCN(S(C)(=O)=O)CC1
InChIInChI=1S/C7H16N2O2S/c1-8-7-3-5-9(6-4-7)12(2,10)11/h7-8H,3-6H2,1-2H3
InChIKeyVCBIBMMEIOUYBB-UHFFFAOYSA-N
XLogP-0.37
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-methylsulfonylpiperidin-4-amine?
The IUPAC name of N-methyl-1-methylsulfonylpiperidin-4-amine (CID 18758393) is N-methyl-1-methylsulfonylpiperidin-4-amine.
What is the SMILES notation for N-methyl-1-methylsulfonylpiperidin-4-amine?
The canonical SMILES for N-methyl-1-methylsulfonylpiperidin-4-amine is CNC1CCN(S(C)(=O)=O)CC1.
What is the InChIKey of N-methyl-1-methylsulfonylpiperidin-4-amine?
The InChIKey is VCBIBMMEIOUYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-8-7-3-5-9(6-4-7)12(2,10)11/h7-8H,3-6H2,1-2H3.
What are the key properties of N-methyl-1-methylsulfonylpiperidin-4-amine?
N-methyl-1-methylsulfonylpiperidin-4-amine has a molecular weight of 192.28 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-methylsulfonylpiperidin-4-amine is sourced from PubChem (CID 18758393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).