5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine

C14H16N2O4 — CID 141069506

IUPAC5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine
SMILESCOc1ccc(-c2cnc(OC)nc2OC)c(OC)c1
InChIInChI=1S/C14H16N2O4/c1-17-9-5-6-10(12(7-9)18-2)11-8-15-14(20-4)16-13(11)19-3/h5-8H,1-4H3
InChIKeyRGDUTFOXTHDLBE-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.18
Rot. Bonds5

About 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine

5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine (PubChem CID 141069506) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine.

Molecular Properties

Compound Name5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine
PubChem CID141069506
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine
SMILESCOc1ccc(-c2cnc(OC)nc2OC)c(OC)c1
InChIInChI=1S/C14H16N2O4/c1-17-9-5-6-10(12(7-9)18-2)11-8-15-14(20-4)16-13(11)19-3/h5-8H,1-4H3
InChIKeyRGDUTFOXTHDLBE-UHFFFAOYSA-N
XLogP2.18
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[2-(2,4-dimethoxyphenyl)phenyl]-2,4-dimethoxybenzene
CID 70200625
2,4-dimethoxy-5-[6-(3-methoxyphenyl)pyrazin-2-yl]pyrimidine
CID 126473814
methyl 3-chloro-4-(2,4-dimethoxypyrimidin-5-yl)benzoate
CID 67256583
8-(2,4-dimethoxypyrimidin-5-yl)quinoline
CID 39749827
2-chloro-5-(2,4-dimethoxyphenyl)pyridine-4-carboxylic acid
CID 53223746
[5-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]methanol
CID 53273851
4,7-bis(2,4-dimethoxyphenyl)-2,9-diphenyl-1,10-phenanthroline
CID 70909545
4-(2,4-dimethoxyphenyl)pyrimidin-2-amine
CID 39733899
5-(2,4-dimethoxyphenyl)-1,3-oxazole-2-carboxylic acid
CID 82049476
5-(2,4-dimethoxypyrimidin-5-yl)-1H-pyrimidin-6-one
CID 122358570
5-chloro-3-(2,4-dimethoxyphenyl)-1,2,4-triazine
CID 116823727
2,4-dimethoxy-5-(4-propylphenyl)pyrimidine
CID 71176850

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine?
The IUPAC name of 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine (CID 141069506) is 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine.
What is the SMILES notation for 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine?
The canonical SMILES for 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine is COc1ccc(-c2cnc(OC)nc2OC)c(OC)c1.
What is the InChIKey of 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine?
The InChIKey is RGDUTFOXTHDLBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-17-9-5-6-10(12(7-9)18-2)11-8-15-14(20-4)16-13(11)19-3/h5-8H,1-4H3.
What are the key properties of 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine?
5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine has a molecular weight of 276.29 g/mol, XLogP of 2.18, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethoxyphenyl)-2,4-dimethoxypyrimidine is sourced from PubChem (CID 141069506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).