2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine

C13H14N4O — CID 73439790

IUPAC2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine
SMILESc1ncc(-c2ccc(C3CNCCO3)nc2)cn1
InChIInChI=1S/C13H14N4O/c1-2-12(13-8-14-3-4-18-13)17-7-10(1)11-5-15-9-16-6-11/h1-2,5-7,9,13-14H,3-4,8H2
InChIKeyZPNOIDUCOCIXJN-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.20
Rot. Bonds2

About 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine

2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine (PubChem CID 73439790) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine.

Molecular Properties

Compound Name2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine
PubChem CID73439790
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine
SMILESc1ncc(-c2ccc(C3CNCCO3)nc2)cn1
InChIInChI=1S/C13H14N4O/c1-2-12(13-8-14-3-4-18-13)17-7-10(1)11-5-15-9-16-6-11/h1-2,5-7,9,13-14H,3-4,8H2
InChIKeyZPNOIDUCOCIXJN-UHFFFAOYSA-N
XLogP1.20
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine?
The IUPAC name of 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine (CID 73439790) is 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine.
What is the SMILES notation for 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine?
The canonical SMILES for 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine is c1ncc(-c2ccc(C3CNCCO3)nc2)cn1.
What is the InChIKey of 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine?
The InChIKey is ZPNOIDUCOCIXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-2-12(13-8-14-3-4-18-13)17-7-10(1)11-5-15-9-16-6-11/h1-2,5-7,9,13-14H,3-4,8H2.
What are the key properties of 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine?
2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine has a molecular weight of 242.28 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-pyrimidin-5-yl-2-pyridinyl)morpholine is sourced from PubChem (CID 73439790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).