5-(4-pyridin-3-yloxyphenyl)pyrimidine

C15H11N3O — CID 166380343

IUPAC5-(4-pyridin-3-yloxyphenyl)pyrimidine
SMILESc1cncc(Oc2ccc(-c3cncnc3)cc2)c1
InChIInChI=1S/C15H11N3O/c1-2-15(10-16-7-1)19-14-5-3-12(4-6-14)13-8-17-11-18-9-13/h1-11H
InChIKeyPNWMPYHGGJJWPC-UHFFFAOYSA-N
MW249.27 g/mol
LogP3.33
Rot. Bonds3

About 5-(4-pyridin-3-yloxyphenyl)pyrimidine

5-(4-pyridin-3-yloxyphenyl)pyrimidine (PubChem CID 166380343) has the molecular formula C15H11N3O and a molecular weight of 249.27 g/mol. Its IUPAC name is 5-(4-pyridin-3-yloxyphenyl)pyrimidine.

Molecular Properties

Compound Name5-(4-pyridin-3-yloxyphenyl)pyrimidine
PubChem CID166380343
Molecular FormulaC15H11N3O
Molecular Weight249.27 g/mol
Exact Mass249.09
IUPAC Name5-(4-pyridin-3-yloxyphenyl)pyrimidine
SMILESc1cncc(Oc2ccc(-c3cncnc3)cc2)c1
InChIInChI=1S/C15H11N3O/c1-2-15(10-16-7-1)19-14-5-3-12(4-6-14)13-8-17-11-18-9-13/h1-11H
InChIKeyPNWMPYHGGJJWPC-UHFFFAOYSA-N
XLogP3.33
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-phenoxyphenyl)pyrimidine;propane
CID 153341834
3-[4-(4-fluorophenoxy)phenyl]pyridine
CID 91298278
3-[4-(1H-pyrazol-5-yl)phenoxy]pyridine
CID 177376371
4-pyridin-3-yloxybenzoic acid
CID 22261667
5-(4-pyridin-3-yloxyphenyl)-1,3,4-oxadiazol-2-amine;hydrobromide
CID 68679658
3-azulen-6-ylpyridine
CID 86232079
2-(4-pyridin-3-yloxyphenyl)ethanamine
CID 63815033
1-(4-pyridin-3-yloxyphenyl)ethanone
CID 3016094
3-(4-butan-2-ylphenoxy)pyridine
CID 143794326
2,3-dipyridin-3-yloxypyrazine
CID 139072759
3-(4-propan-2-yloxyphenyl)pyridine
CID 91807940
5-[3,5-bis[3-(3-pyridin-3-ylphenyl)phenyl]phenyl]pyrimidine;5-[3,5-bis[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]pyrimidine;5-[3,5-bis[3-(3-pyrimidin-5-ylphenyl)phenyl]phenyl]pyrimidine
CID 165097309

Frequently Asked Questions

What is the IUPAC name of 5-(4-pyridin-3-yloxyphenyl)pyrimidine?
The IUPAC name of 5-(4-pyridin-3-yloxyphenyl)pyrimidine (CID 166380343) is 5-(4-pyridin-3-yloxyphenyl)pyrimidine.
What is the SMILES notation for 5-(4-pyridin-3-yloxyphenyl)pyrimidine?
The canonical SMILES for 5-(4-pyridin-3-yloxyphenyl)pyrimidine is c1cncc(Oc2ccc(-c3cncnc3)cc2)c1.
What is the InChIKey of 5-(4-pyridin-3-yloxyphenyl)pyrimidine?
The InChIKey is PNWMPYHGGJJWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11N3O/c1-2-15(10-16-7-1)19-14-5-3-12(4-6-14)13-8-17-11-18-9-13/h1-11H.
What are the key properties of 5-(4-pyridin-3-yloxyphenyl)pyrimidine?
5-(4-pyridin-3-yloxyphenyl)pyrimidine has a molecular weight of 249.27 g/mol, XLogP of 3.33, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-pyridin-3-yloxyphenyl)pyrimidine is sourced from PubChem (CID 166380343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).