4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine

C14H16N2O4 — CID 118741260

IUPAC4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine
SMILESCOc1cc(-c2cc(OC)c(OC)c(OC)c2)ncn1
InChIInChI=1S/C14H16N2O4/c1-17-11-5-9(6-12(18-2)14(11)20-4)10-7-13(19-3)16-8-15-10/h5-8H,1-4H3
InChIKeySGEVWTVLUUAHQZ-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.18
Rot. Bonds5

About 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine

4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine (PubChem CID 118741260) has the molecular formula C14H16N2O4 and a molecular weight of 276.29 g/mol. Its IUPAC name is 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine.

Molecular Properties

Compound Name4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine
PubChem CID118741260
Molecular FormulaC14H16N2O4
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC Name4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine
SMILESCOc1cc(-c2cc(OC)c(OC)c(OC)c2)ncn1
InChIInChI=1S/C14H16N2O4/c1-17-11-5-9(6-12(18-2)14(11)20-4)10-7-13(19-3)16-8-15-10/h5-8H,1-4H3
InChIKeySGEVWTVLUUAHQZ-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

4-(3,4,5-trimethoxyphenyl)-1,3-thiazole
CID 4262449
5-(6-methoxypyrimidin-4-yl)-2-methylphenol
CID 155407722
5-(3,4-dimethoxyphenyl)-2-(3,4,5-trimethoxyphenyl)pyridine
CID 90670581
(6-phenylpyrimidin-4-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 53364049
2-(3,4,5-trimethoxyphenyl)pyridine-4-carboxylate
CID 22938063
3,6-bis(4-methylphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine
CID 18874648
3-(3,4-dimethoxyphenyl)-6-(3,4,5-trimethoxyphenyl)-1,2,4-triazine
CID 67422117
2-chloro-4-(3,4,5-trimethoxyphenyl)pyridine
CID 18674967
2-(6-methoxypyrimidin-4-yl)phenol
CID 608793
3-bromo-5-methoxy-4-(6-phenylpyrimidin-4-yl)oxybenzaldehyde
CID 16643335
3-[2-(3,4,5-trimethoxyphenyl)-4-pyridinyl]propan-1-ol
CID 18674989
O-(6-methoxypyrimidin-4-yl)hydroxylamine
CID 79421362

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine?
The IUPAC name of 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine (CID 118741260) is 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine.
What is the SMILES notation for 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine?
The canonical SMILES for 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine is COc1cc(-c2cc(OC)c(OC)c(OC)c2)ncn1.
What is the InChIKey of 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine?
The InChIKey is SGEVWTVLUUAHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4/c1-17-11-5-9(6-12(18-2)14(11)20-4)10-7-13(19-3)16-8-15-10/h5-8H,1-4H3.
What are the key properties of 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine?
4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine 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 4-methoxy-6-(3,4,5-trimethoxyphenyl)pyrimidine is sourced from PubChem (CID 118741260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).