N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine

C13H26N2O2 — CID 75443090

IUPACN-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine
SMILESCC(NCCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-12(13-2-8-16-9-3-13)14-4-5-15-6-10-17-11-7-15/h12-14H,2-11H2,1H3
InChIKeyMBYNRSOENPBHSB-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.72
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine

N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine (PubChem CID 75443090) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine
PubChem CID75443090
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine
SMILESCC(NCCN1CCOCC1)C1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-12(13-2-8-16-9-3-13)14-4-5-15-6-10-17-11-7-15/h12-14H,2-11H2,1H3
InChIKeyMBYNRSOENPBHSB-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine?
The IUPAC name of N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine (CID 75443090) is N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine is CC(NCCN1CCOCC1)C1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine?
The InChIKey is MBYNRSOENPBHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-12(13-2-8-16-9-3-13)14-4-5-15-6-10-17-11-7-15/h12-14H,2-11H2,1H3.
What are the key properties of N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine?
N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine has a molecular weight of 242.36 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-1-(oxan-4-yl)ethanamine is sourced from PubChem (CID 75443090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).