N,N-dimethyl-1-methylsulfonylpiperidin-3-amine

C8H18N2O2S — CID 58035151

IUPACN,N-dimethyl-1-methylsulfonylpiperidin-3-amine
SMILESCN(C)C1CCCN(S(C)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-9(2)8-5-4-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3
InChIKeyFTLAPUZDUHDGGU-UHFFFAOYSA-N
MW206.31 g/mol
LogP-0.03
Rot. Bonds2

About N,N-dimethyl-1-methylsulfonylpiperidin-3-amine

N,N-dimethyl-1-methylsulfonylpiperidin-3-amine (PubChem CID 58035151) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N,N-dimethyl-1-methylsulfonylpiperidin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-methylsulfonylpiperidin-3-amine
PubChem CID58035151
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC NameN,N-dimethyl-1-methylsulfonylpiperidin-3-amine
SMILESCN(C)C1CCCN(S(C)(=O)=O)C1
InChIInChI=1S/C8H18N2O2S/c1-9(2)8-5-4-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3
InChIKeyFTLAPUZDUHDGGU-UHFFFAOYSA-N
XLogP-0.03
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N,N-dimethyl-1-methylsulfonylpiperidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-methylsulfonylpiperidin-3-amine?
The IUPAC name of N,N-dimethyl-1-methylsulfonylpiperidin-3-amine (CID 58035151) is N,N-dimethyl-1-methylsulfonylpiperidin-3-amine.
What is the SMILES notation for N,N-dimethyl-1-methylsulfonylpiperidin-3-amine?
The canonical SMILES for N,N-dimethyl-1-methylsulfonylpiperidin-3-amine is CN(C)C1CCCN(S(C)(=O)=O)C1.
What is the InChIKey of N,N-dimethyl-1-methylsulfonylpiperidin-3-amine?
The InChIKey is FTLAPUZDUHDGGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-9(2)8-5-4-6-10(7-8)13(3,11)12/h8H,4-7H2,1-3H3.
What are the key properties of N,N-dimethyl-1-methylsulfonylpiperidin-3-amine?
N,N-dimethyl-1-methylsulfonylpiperidin-3-amine has a molecular weight of 206.31 g/mol, XLogP of -0.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-methylsulfonylpiperidin-3-amine is sourced from PubChem (CID 58035151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).