4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine

C12H13N3O2 — CID 167895848

IUPAC4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine
SMILESCCOc1ccnc(Oc2ccc(C)nc2)n1
InChIInChI=1S/C12H13N3O2/c1-3-16-11-6-7-13-12(15-11)17-10-5-4-9(2)14-8-10/h4-8H,3H2,1-2H3
InChIKeyOEVKOZFEFKRTKR-UHFFFAOYSA-N
MW231.25 g/mol
LogP2.37
Rot. Bonds4

About 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine

4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine (PubChem CID 167895848) has the molecular formula C12H13N3O2 and a molecular weight of 231.25 g/mol. Its IUPAC name is 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine.

Molecular Properties

Compound Name4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine
PubChem CID167895848
Molecular FormulaC12H13N3O2
Molecular Weight231.25 g/mol
Exact Mass231.10
IUPAC Name4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine
SMILESCCOc1ccnc(Oc2ccc(C)nc2)n1
InChIInChI=1S/C12H13N3O2/c1-3-16-11-6-7-13-12(15-11)17-10-5-4-9(2)14-8-10/h4-8H,3H2,1-2H3
InChIKeyOEVKOZFEFKRTKR-UHFFFAOYSA-N
XLogP2.37
TPSA57.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.25
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[(6-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]methanamine
CID 107542658
4-ethoxy-6-[(6-methyl-3-pyridinyl)oxy]-1,3,5-triazin-2-amine
CID 80872302
5-ethoxy-2-methylpyridine
CID 573198
5-(bromomethyl)-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine
CID 107088241
[4-methyl-2-[(6-methyl-3-pyridinyl)oxy]pyrimidin-5-yl]methanol
CID 83184999
4-methyl-2-pyridin-3-yloxypyrimidine
CID 155798550
2-(4-ethoxypyrimidin-2-yl)oxyethanamine
CID 112639005
2-ethoxy-4-methoxypyrimidine
CID 119088608
6-[(6-methyl-3-pyridinyl)oxy]-N-propylpyrazin-2-amine
CID 80873646
4-methyl-2-(4-methylphenoxy)pyrimidine
CID 155309034
N-[[4-methyl-2-[(6-methyl-3-pyridinyl)oxy]pyrimidin-5-yl]methyl]propan-2-amine
CID 83189037
5-butoxy-2-methylpyridine
CID 13154052

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine?
The IUPAC name of 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine (CID 167895848) is 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine.
What is the SMILES notation for 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine?
The canonical SMILES for 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine is CCOc1ccnc(Oc2ccc(C)nc2)n1.
What is the InChIKey of 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine?
The InChIKey is OEVKOZFEFKRTKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O2/c1-3-16-11-6-7-13-12(15-11)17-10-5-4-9(2)14-8-10/h4-8H,3H2,1-2H3.
What are the key properties of 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine?
4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine has a molecular weight of 231.25 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-2-[(6-methyl-3-pyridinyl)oxy]pyrimidine is sourced from PubChem (CID 167895848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).