2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine

C15H30N2O — CID 79926978

IUPAC2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine
SMILESCC1(C)CC(N2CCC(CCN)CC2)C(C)(C)O1
InChIInChI=1S/C15H30N2O/c1-14(2)11-13(15(3,4)18-14)17-9-6-12(5-8-16)7-10-17/h12-13H,5-11,16H2,1-4H3
InChIKeyVWBZTEZXLRQZNY-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.39
Rot. Bonds3

About 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine

2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine (PubChem CID 79926978) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine
PubChem CID79926978
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine
SMILESCC1(C)CC(N2CCC(CCN)CC2)C(C)(C)O1
InChIInChI=1S/C15H30N2O/c1-14(2)11-13(15(3,4)18-14)17-9-6-12(5-8-16)7-10-17/h12-13H,5-11,16H2,1-4H3
InChIKeyVWBZTEZXLRQZNY-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine?
The IUPAC name of 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine (CID 79926978) is 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine.
What is the SMILES notation for 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine?
The canonical SMILES for 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine is CC1(C)CC(N2CCC(CCN)CC2)C(C)(C)O1.
What is the InChIKey of 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine?
The InChIKey is VWBZTEZXLRQZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-14(2)11-13(15(3,4)18-14)17-9-6-12(5-8-16)7-10-17/h12-13H,5-11,16H2,1-4H3.
What are the key properties of 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine?
2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine has a molecular weight of 254.42 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-yl]ethanamine is sourced from PubChem (CID 79926978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).