1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine

C13H21N3O — CID 79666705

IUPAC1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine
SMILESCCN1CCOC(C(N)Cc2ccncc2)C1
InChIInChI=1S/C13H21N3O/c1-2-16-7-8-17-13(10-16)12(14)9-11-3-5-15-6-4-11/h3-6,12-13H,2,7-10,14H2,1H3
InChIKeyGGHAVXSTNXHDQZ-UHFFFAOYSA-N
MW235.33 g/mol
LogP0.67
Rot. Bonds4

About 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine

1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine (PubChem CID 79666705) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine.

Molecular Properties

Compound Name1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine
PubChem CID79666705
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine
SMILESCCN1CCOC(C(N)Cc2ccncc2)C1
InChIInChI=1S/C13H21N3O/c1-2-16-7-8-17-13(10-16)12(14)9-11-3-5-15-6-4-11/h3-6,12-13H,2,7-10,14H2,1H3
InChIKeyGGHAVXSTNXHDQZ-UHFFFAOYSA-N
XLogP0.67
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine?
The IUPAC name of 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine (CID 79666705) is 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine.
What is the SMILES notation for 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine?
The canonical SMILES for 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine is CCN1CCOC(C(N)Cc2ccncc2)C1.
What is the InChIKey of 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine?
The InChIKey is GGHAVXSTNXHDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-16-7-8-17-13(10-16)12(14)9-11-3-5-15-6-4-11/h3-6,12-13H,2,7-10,14H2,1H3.
What are the key properties of 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine?
1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine has a molecular weight of 235.33 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylmorpholin-2-yl)-2-pyridin-4-ylethanamine is sourced from PubChem (CID 79666705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).