2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine

C13H28N4O — CID 155306319

IUPAC2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine
SMILESNCCN1CCOC(C2CCCCN2CCN)C1
InChIInChI=1S/C13H28N4O/c14-4-7-16-9-10-18-13(11-16)12-3-1-2-6-17(12)8-5-15/h12-13H,1-11,14-15H2
InChIKeyGSIXWFLDIFFDCN-UHFFFAOYSA-N
MW256.39 g/mol
LogP-0.54
Rot. Bonds5

About 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine

2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine (PubChem CID 155306319) has the molecular formula C13H28N4O and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine.

Molecular Properties

Compound Name2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine
PubChem CID155306319
Molecular FormulaC13H28N4O
Molecular Weight256.39 g/mol
Exact Mass256.23
IUPAC Name2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine
SMILESNCCN1CCOC(C2CCCCN2CCN)C1
InChIInChI=1S/C13H28N4O/c14-4-7-16-9-10-18-13(11-16)12-3-1-2-6-17(12)8-5-15/h12-13H,1-11,14-15H2
InChIKeyGSIXWFLDIFFDCN-UHFFFAOYSA-N
XLogP-0.54
TPSA67.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 5-0.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine?
The IUPAC name of 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine (CID 155306319) is 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine.
What is the SMILES notation for 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine?
The canonical SMILES for 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine is NCCN1CCOC(C2CCCCN2CCN)C1.
What is the InChIKey of 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine?
The InChIKey is GSIXWFLDIFFDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N4O/c14-4-7-16-9-10-18-13(11-16)12-3-1-2-6-17(12)8-5-15/h12-13H,1-11,14-15H2.
What are the key properties of 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine?
2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine has a molecular weight of 256.39 g/mol, XLogP of -0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(2-aminoethyl)piperidin-2-yl]morpholin-4-yl]ethanamine is sourced from PubChem (CID 155306319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).