N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine

C11H24N2O2S — CID 66273209

IUPACN-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
SMILESCN(CCC1CCCCN1)CCS(C)(=O)=O
InChIInChI=1S/C11H24N2O2S/c1-13(9-10-16(2,14)15)8-6-11-5-3-4-7-12-11/h11-12H,3-10H2,1-2H3
InChIKeyRCHKYJASQKBVTM-UHFFFAOYSA-N
MW248.39 g/mol
LogP0.50
Rot. Bonds6

About N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine

N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine (PubChem CID 66273209) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
PubChem CID66273209
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC NameN-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
SMILESCN(CCC1CCCCN1)CCS(C)(=O)=O
InChIInChI=1S/C11H24N2O2S/c1-13(9-10-16(2,14)15)8-6-11-5-3-4-7-12-11/h11-12H,3-10H2,1-2H3
InChIKeyRCHKYJASQKBVTM-UHFFFAOYSA-N
XLogP0.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
CID 80696333
N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
CID 112659937
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
CID 61429136
N-(dimethylsulfamoyl)-N-methyl-2-piperidin-2-ylethanamine
CID 43210873
N,N-dimethyl-2-[(2S)-piperidin-2-yl]ethanamine
CID 7019358
N-methyl-2-piperidin-2-yl-N-propylethanesulfonamide
CID 60863663
N-[2-(dimethylamino)ethyl]-N-methyl-2-piperidin-2-ylethanesulfonamide
CID 63700740
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butane-1-sulfonamide
CID 63855870
N-ethyl-2-methylsulfonyl-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 106615294
N-methyl-N-(2-piperidin-2-ylethyl)cyclohexanamine
CID 43149893
2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanamine
CID 84686147
N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 63209345

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine?
The IUPAC name of N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine (CID 66273209) is N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine.
What is the SMILES notation for N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine?
The canonical SMILES for N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine is CN(CCC1CCCCN1)CCS(C)(=O)=O.
What is the InChIKey of N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine?
The InChIKey is RCHKYJASQKBVTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2S/c1-13(9-10-16(2,14)15)8-6-11-5-3-4-7-12-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine?
N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine has a molecular weight of 248.39 g/mol, XLogP of 0.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine is sourced from PubChem (CID 66273209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).