1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone

C15H22N4O3 — CID 118740114

IUPAC1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone
SMILESNc1cccc(C2CN(C(=O)CN3CCOCC3)CCO2)n1
InChIInChI=1S/C15H22N4O3/c16-14-3-1-2-12(17-14)13-10-19(6-9-22-13)15(20)11-18-4-7-21-8-5-18/h1-3,13H,4-11H2,(H2,16,17)
InChIKeyCWDZDWKPZHTAEH-UHFFFAOYSA-N
MW306.37 g/mol
LogP-0.10
Rot. Bonds3

About 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone

1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone (PubChem CID 118740114) has the molecular formula C15H22N4O3 and a molecular weight of 306.37 g/mol. Its IUPAC name is 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone.

Molecular Properties

Compound Name1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone
PubChem CID118740114
Molecular FormulaC15H22N4O3
Molecular Weight306.37 g/mol
Exact Mass306.17
IUPAC Name1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone
SMILESNc1cccc(C2CN(C(=O)CN3CCOCC3)CCO2)n1
InChIInChI=1S/C15H22N4O3/c16-14-3-1-2-12(17-14)13-10-19(6-9-22-13)15(20)11-18-4-7-21-8-5-18/h1-3,13H,4-11H2,(H2,16,17)
InChIKeyCWDZDWKPZHTAEH-UHFFFAOYSA-N
XLogP-0.10
TPSA80.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone?
The IUPAC name of 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone (CID 118740114) is 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone.
What is the SMILES notation for 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone?
The canonical SMILES for 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone is Nc1cccc(C2CN(C(=O)CN3CCOCC3)CCO2)n1.
What is the InChIKey of 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone?
The InChIKey is CWDZDWKPZHTAEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3/c16-14-3-1-2-12(17-14)13-10-19(6-9-22-13)15(20)11-18-4-7-21-8-5-18/h1-3,13H,4-11H2,(H2,16,17).
What are the key properties of 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone?
1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone has a molecular weight of 306.37 g/mol, XLogP of -0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-morpholin-4-ylethanone is sourced from PubChem (CID 118740114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).