N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine

C13H28N2O — CID 115728653

IUPACN-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCOC(C)(C)CNC1CC(C)N(C)CC1C
InChIInChI=1S/C13H28N2O/c1-10-8-15(5)11(2)7-12(10)14-9-13(3,4)16-6/h10-12,14H,7-9H2,1-6H3
InChIKeyLWKQILSUPXENCC-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.73
Rot. Bonds4

About N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine

N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 115728653) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID115728653
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCOC(C)(C)CNC1CC(C)N(C)CC1C
InChIInChI=1S/C13H28N2O/c1-10-8-15(5)11(2)7-12(10)14-9-13(3,4)16-6/h10-12,14H,7-9H2,1-6H3
InChIKeyLWKQILSUPXENCC-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethyl-2-methylsulfanylbutyl)-1,2,5-trimethylpiperidin-4-amine
CID 103787192
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
CID 54967617
(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
N'-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60890113
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1,2,5-trimethylpiperidin-4-amine
CID 113349006
1,2,5-trimethyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-4-amine
CID 55259527
tert-butyl N-[4-[(1,2,5-trimethylpiperidin-4-yl)amino]butan-2-yl]carbamate
CID 103901731
3-ethyl-1-[(1,2,5-trimethylpiperidin-4-yl)amino]pentan-2-ol
CID 103783038
2-[(1,2,5-trimethylpiperidin-4-yl)amino]acetamide
CID 43665297

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine (CID 115728653) is N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine is COC(C)(C)CNC1CC(C)N(C)CC1C.
What is the InChIKey of N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is LWKQILSUPXENCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-10-8-15(5)11(2)7-12(10)14-9-13(3,4)16-6/h10-12,14H,7-9H2,1-6H3.
What are the key properties of N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine?
N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-methylpropyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 115728653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).