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

C11H24N2S — CID 112659937

IUPACN-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
SMILESCSCCN(C)CCC1CCCCN1
InChIInChI=1S/C11H24N2S/c1-13(9-10-14-2)8-6-11-5-3-4-7-12-11/h11-12H,3-10H2,1-2H3
InChIKeyQABHFJBJPWPIIY-UHFFFAOYSA-N
MW216.39 g/mol
LogP1.81
Rot. Bonds6

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

N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine (PubChem CID 112659937) has the molecular formula C11H24N2S and a molecular weight of 216.39 g/mol. Its IUPAC name is N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine.

Molecular Properties

Compound NameN-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
PubChem CID112659937
Molecular FormulaC11H24N2S
Molecular Weight216.39 g/mol
Exact Mass216.17
IUPAC NameN-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine
SMILESCSCCN(C)CCC1CCCCN1
InChIInChI=1S/C11H24N2S/c1-13(9-10-14-2)8-6-11-5-3-4-7-12-11/h11-12H,3-10H2,1-2H3
InChIKeyQABHFJBJPWPIIY-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.39
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoroethyl)-N-methyl-2-piperidin-2-ylethanamine
CID 80696333
N,3-dimethyl-N-(2-piperidin-2-ylethyl)butan-1-amine
CID 61429136
N,N-dimethyl-2-[(2S)-piperidin-2-yl]ethanamine
CID 7019358
N-methyl-N-(2-methylsulfonylethyl)-2-piperidin-2-ylethanamine
CID 66273209
2-(2-methylsulfanylethyl)pyrrolidine
CID 81142989
2-(3-methylsulfanylpropyl)pyrrolidine
CID 62479260
N-methyl-N-(2-piperidin-2-ylethyl)cyclohexanamine
CID 43149893
N-methyl-2-pyrrolidin-2-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 63209345
N-methyl-N-[2-(3-methylphenyl)ethyl]-2-piperidin-2-ylethanamine
CID 115211204
N,N-dimethyl-2-[(2S)-pyrrolidin-2-yl]ethanamine;dihydrochloride
CID 155100868
N,N-dimethyl-4-piperidin-2-ylbutan-1-amine
CID 15057317
N-(2-methoxyethyl)-N-methyl-3-piperidin-2-ylpropan-1-amine
CID 62212504

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine?
The IUPAC name of N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine (CID 112659937) is N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine.
What is the SMILES notation for N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine?
The canonical SMILES for N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine is CSCCN(C)CCC1CCCCN1.
What is the InChIKey of N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine?
The InChIKey is QABHFJBJPWPIIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2S/c1-13(9-10-14-2)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-methylsulfanylethyl)-2-piperidin-2-ylethanamine?
N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine has a molecular weight of 216.39 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylsulfanylethyl)-2-piperidin-2-ylethanamine is sourced from PubChem (CID 112659937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).