2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine

C16H34N2O — CID 115942852

IUPAC2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C16H34N2O/c1-15(2,3)17-13-14-7-9-18(10-8-14)11-12-19-16(4,5)6/h14,17H,7-13H2,1-6H3
InChIKeyLTSQGNLYSTVBRF-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.90
Rot. Bonds5

About 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine

2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine (PubChem CID 115942852) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine
PubChem CID115942852
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C16H34N2O/c1-15(2,3)17-13-14-7-9-18(10-8-14)11-12-19-16(4,5)6/h14,17H,7-13H2,1-6H3
InChIKeyLTSQGNLYSTVBRF-UHFFFAOYSA-N
XLogP2.90
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine (CID 115942852) is 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine is CC(C)(C)NCC1CCN(CCOC(C)(C)C)CC1.
What is the InChIKey of 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine?
The InChIKey is LTSQGNLYSTVBRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-15(2,3)17-13-14-7-9-18(10-8-14)11-12-19-16(4,5)6/h14,17H,7-13H2,1-6H3.
What are the key properties of 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine?
2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine has a molecular weight of 270.46 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 115942852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).