morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone

C14H19N3O3 — CID 647844

IUPACmorpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCOCC2)nc1)N1CCOCC1
InChIInChI=1S/C14H19N3O3/c18-14(17-5-9-20-10-6-17)12-1-2-13(15-11-12)16-3-7-19-8-4-16/h1-2,11H,3-10H2
InChIKeyXTRZGPQBACSHHV-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.39
Rot. Bonds2

About morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone

morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone (PubChem CID 647844) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Namemorpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone
PubChem CID647844
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Namemorpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone
SMILESO=C(c1ccc(N2CCOCC2)nc1)N1CCOCC1
InChIInChI=1S/C14H19N3O3/c18-14(17-5-9-20-10-6-17)12-1-2-13(15-11-12)16-3-7-19-8-4-16/h1-2,11H,3-10H2
InChIKeyXTRZGPQBACSHHV-UHFFFAOYSA-N
XLogP0.39
TPSA54.90 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone?
The IUPAC name of morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone (CID 647844) is morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone.
What is the SMILES notation for morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone?
The canonical SMILES for morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone is O=C(c1ccc(N2CCOCC2)nc1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone?
The InChIKey is XTRZGPQBACSHHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c18-14(17-5-9-20-10-6-17)12-1-2-13(15-11-12)16-3-7-19-8-4-16/h1-2,11H,3-10H2.
What are the key properties of morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone?
morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone has a molecular weight of 277.32 g/mol, XLogP of 0.39, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-(6-morpholin-4-yl-3-pyridinyl)methanone is sourced from PubChem (CID 647844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).