N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine

C11H24N2S — CID 63967413

IUPACN-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine
SMILESCNC1CCN(CC(C)CSC)CC1
InChIInChI=1S/C11H24N2S/c1-10(9-14-3)8-13-6-4-11(12-2)5-7-13/h10-12H,4-9H2,1-3H3
InChIKeyWPKMWVNCBLNLOB-UHFFFAOYSA-N
MW216.39 g/mol
LogP1.67
Rot. Bonds5

About N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine

N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine (PubChem CID 63967413) has the molecular formula C11H24N2S and a molecular weight of 216.39 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine
PubChem CID63967413
Molecular FormulaC11H24N2S
Molecular Weight216.39 g/mol
Exact Mass216.17
IUPAC NameN-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine
SMILESCNC1CCN(CC(C)CSC)CC1
InChIInChI=1S/C11H24N2S/c1-10(9-14-3)8-13-6-4-11(12-2)5-7-13/h10-12H,4-9H2,1-3H3
InChIKeyWPKMWVNCBLNLOB-UHFFFAOYSA-N
XLogP1.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.39
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine?
The IUPAC name of N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine (CID 63967413) is N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine.
What is the SMILES notation for N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine?
The canonical SMILES for N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine is CNC1CCN(CC(C)CSC)CC1.
What is the InChIKey of N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine?
The InChIKey is WPKMWVNCBLNLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2S/c1-10(9-14-3)8-13-6-4-11(12-2)5-7-13/h10-12H,4-9H2,1-3H3.
What are the key properties of N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine?
N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine has a molecular weight of 216.39 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-3-methylsulfanylpropyl)piperidin-4-amine is sourced from PubChem (CID 63967413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).