2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine

C12H24N2O — CID 82692525

IUPAC2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine
SMILESNCCOC1CCN(CCC2CC2)CC1
InChIInChI=1S/C12H24N2O/c13-6-10-15-12-4-8-14(9-5-12)7-3-11-1-2-11/h11-12H,1-10,13H2
InChIKeyQMHHFOVBJVUMPQ-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.23
Rot. Bonds6

About 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine

2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine (PubChem CID 82692525) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine.

Molecular Properties

Compound Name2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine
PubChem CID82692525
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine
SMILESNCCOC1CCN(CCC2CC2)CC1
InChIInChI=1S/C12H24N2O/c13-6-10-15-12-4-8-14(9-5-12)7-3-11-1-2-11/h11-12H,1-10,13H2
InChIKeyQMHHFOVBJVUMPQ-UHFFFAOYSA-N
XLogP1.23
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine?
The IUPAC name of 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine (CID 82692525) is 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine.
What is the SMILES notation for 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine?
The canonical SMILES for 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine is NCCOC1CCN(CCC2CC2)CC1.
What is the InChIKey of 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine?
The InChIKey is QMHHFOVBJVUMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c13-6-10-15-12-4-8-14(9-5-12)7-3-11-1-2-11/h11-12H,1-10,13H2.
What are the key properties of 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine?
2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine has a molecular weight of 212.34 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-cyclopropylethyl)piperidin-4-yl]oxyethanamine is sourced from PubChem (CID 82692525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).