N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine

C15H32N2S — CID 103787192

IUPACN-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCCC(CC)(CNC1CC(C)N(C)CC1C)SC
InChIInChI=1S/C15H32N2S/c1-7-15(8-2,18-6)11-16-14-9-13(4)17(5)10-12(14)3/h12-14,16H,7-11H2,1-6H3
InChIKeyUZNWXFMWFYRUGO-UHFFFAOYSA-N
MW272.50 g/mol
LogP3.23
Rot. Bonds6

About N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine

N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 103787192) has the molecular formula C15H32N2S and a molecular weight of 272.50 g/mol. Its IUPAC name is N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID103787192
Molecular FormulaC15H32N2S
Molecular Weight272.50 g/mol
Exact Mass272.23
IUPAC NameN-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCCC(CC)(CNC1CC(C)N(C)CC1C)SC
InChIInChI=1S/C15H32N2S/c1-7-15(8-2,18-6)11-16-14-9-13(4)17(5)10-12(14)3/h12-14,16H,7-11H2,1-6H3
InChIKeyUZNWXFMWFYRUGO-UHFFFAOYSA-N
XLogP3.23
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
CID 115728653
N-(2-ethyl-2-methylsulfanylbutyl)-2-methylcyclopentan-1-amine
CID 115689631
(2S)-1-[(1,2,5-trimethylpiperidin-4-yl)amino]propan-2-ol
CID 103906573
(2S)-1-[[(2R,4R,5S)-1,2,5-trimethylpiperidin-4-yl]amino]propan-2-ol
CID 124526610
(2R,4S,5S)-1,2,5-trimethyl-N-pentylpiperidin-4-amine
CID 93258445
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534
2-[(1,2,5-trimethylpiperidin-4-yl)amino]acetamide
CID 43665297
3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol
CID 103783038
N'-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60890113
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
CID 54967617
1,2,5-trimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-amine
CID 54860823
N',N'-dimethyl-N-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 5149120

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine (CID 103787192) is N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine is CCC(CC)(CNC1CC(C)N(C)CC1C)SC.
What is the InChIKey of N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is UZNWXFMWFYRUGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2S/c1-7-15(8-2,18-6)11-16-14-9-13(4)17(5)10-12(14)3/h12-14,16H,7-11H2,1-6H3.
What are the key properties of N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine?
N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 272.50 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 103787192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).