2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine

C12H25N3O2 — CID 117009173

IUPAC2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine
SMILESNCCC1COCCN1CCN1CCOCC1
InChIInChI=1S/C12H25N3O2/c13-2-1-12-11-17-10-7-15(12)4-3-14-5-8-16-9-6-14/h12H,1-11,13H2
InChIKeyLCVQAKUQLXCQAL-UHFFFAOYSA-N
MW243.35 g/mol
LogP-0.63
Rot. Bonds5

About 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine

2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine (PubChem CID 117009173) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine
PubChem CID117009173
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC Name2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine
SMILESNCCC1COCCN1CCN1CCOCC1
InChIInChI=1S/C12H25N3O2/c13-2-1-12-11-17-10-7-15(12)4-3-14-5-8-16-9-6-14/h12H,1-11,13H2
InChIKeyLCVQAKUQLXCQAL-UHFFFAOYSA-N
XLogP-0.63
TPSA50.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine?
The IUPAC name of 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine (CID 117009173) is 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine.
What is the SMILES notation for 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine?
The canonical SMILES for 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine is NCCC1COCCN1CCN1CCOCC1.
What is the InChIKey of 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine?
The InChIKey is LCVQAKUQLXCQAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c13-2-1-12-11-17-10-7-15(12)4-3-14-5-8-16-9-6-14/h12H,1-11,13H2.
What are the key properties of 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine?
2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine has a molecular weight of 243.35 g/mol, XLogP of -0.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-morpholin-4-ylethyl)morpholin-3-yl]ethanamine is sourced from PubChem (CID 117009173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).