4-(6-phenylpyrimidin-4-yl)morpholine

C14H15N3O — CID 1082059

IUPAC4-(6-phenylpyrimidin-4-yl)morpholine
SMILESc1ccc(-c2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C14H15N3O/c1-2-4-12(5-3-1)13-10-14(16-11-15-13)17-6-8-18-9-7-17/h1-5,10-11H,6-9H2
InChIKeyWSWBZGOSUZTZPJ-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.98
Rot. Bonds2

About 4-(6-phenylpyrimidin-4-yl)morpholine

4-(6-phenylpyrimidin-4-yl)morpholine (PubChem CID 1082059) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-(6-phenylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(6-phenylpyrimidin-4-yl)morpholine
PubChem CID1082059
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name4-(6-phenylpyrimidin-4-yl)morpholine
SMILESc1ccc(-c2cc(N3CCOCC3)ncn2)cc1
InChIInChI=1S/C14H15N3O/c1-2-4-12(5-3-1)13-10-14(16-11-15-13)17-6-8-18-9-7-17/h1-5,10-11H,6-9H2
InChIKeyWSWBZGOSUZTZPJ-UHFFFAOYSA-N
XLogP1.98
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(6-phenylpyrimidin-4-yl)morpholine?
The IUPAC name of 4-(6-phenylpyrimidin-4-yl)morpholine (CID 1082059) is 4-(6-phenylpyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(6-phenylpyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(6-phenylpyrimidin-4-yl)morpholine is c1ccc(-c2cc(N3CCOCC3)ncn2)cc1.
What is the InChIKey of 4-(6-phenylpyrimidin-4-yl)morpholine?
The InChIKey is WSWBZGOSUZTZPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-2-4-12(5-3-1)13-10-14(16-11-15-13)17-6-8-18-9-7-17/h1-5,10-11H,6-9H2.
What are the key properties of 4-(6-phenylpyrimidin-4-yl)morpholine?
4-(6-phenylpyrimidin-4-yl)morpholine has a molecular weight of 241.29 g/mol, XLogP of 1.98, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-phenylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 1082059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).