4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine

C19H19N3O3 — CID 131941843

IUPAC4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine
SMILESCOc1ccc(OC)c(-c2ncnc(Oc3cccnc3C)c2C)c1
InChIInChI=1S/C19H19N3O3/c1-12-18(15-10-14(23-3)7-8-17(15)24-4)21-11-22-19(12)25-16-6-5-9-20-13(16)2/h5-11H,1-4H3
InChIKeyJNUCDIREWRRYJH-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.96
Rot. Bonds5

About 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine

4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine (PubChem CID 131941843) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine.

Molecular Properties

Compound Name4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine
PubChem CID131941843
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine
SMILESCOc1ccc(OC)c(-c2ncnc(Oc3cccnc3C)c2C)c1
InChIInChI=1S/C19H19N3O3/c1-12-18(15-10-14(23-3)7-8-17(15)24-4)21-11-22-19(12)25-16-6-5-9-20-13(16)2/h5-11H,1-4H3
InChIKeyJNUCDIREWRRYJH-UHFFFAOYSA-N
XLogP3.96
TPSA66.36 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,5-dimethoxyphenyl)-5-methyl-4-[(2-methyl-3-pyridinyl)oxymethyl]-1,3-oxazole
CID 56750354
4-methoxy-2-[(2-methyl-3-pyridinyl)oxy]benzonitrile
CID 81306225
[4-methoxy-2-[(2-methyl-3-pyridinyl)oxy]phenyl]methanamine
CID 81300033
2-(2,5-dimethoxyphenyl)-4-methylpyridin-3-amine
CID 114051131
3-(2-fluoro-4-methoxyphenyl)-2-methylpyridine
CID 118448916
6-(2,5-dimethoxyphenyl)-1,2,4-triazin-5-amine
CID 116822972
3-chloro-2-(2,5-dimethoxyphenyl)-5-methylpyridine
CID 56710784
[3-(2,5-dimethoxyphenyl)pyrazin-2-yl]methanamine
CID 82478923
4-(5-fluoro-2-methoxyphenyl)-6-methylpyrimidin-5-amine
CID 82390103
2-(2,5-dimethoxyphenyl)-7-methoxycyclohepta-2,4,6-trien-1-one
CID 617857
6-(2-tert-butyl-4-methoxyphenoxy)-5-methylpyrimidin-4-amine
CID 80866188
4-(2,5-dimethoxyphenyl)pyrimidine-5-carboxylic acid
CID 82484332

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine?
The IUPAC name of 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine (CID 131941843) is 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine.
What is the SMILES notation for 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine?
The canonical SMILES for 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine is COc1ccc(OC)c(-c2ncnc(Oc3cccnc3C)c2C)c1.
What is the InChIKey of 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine?
The InChIKey is JNUCDIREWRRYJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-12-18(15-10-14(23-3)7-8-17(15)24-4)21-11-22-19(12)25-16-6-5-9-20-13(16)2/h5-11H,1-4H3.
What are the key properties of 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine?
4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine has a molecular weight of 337.38 g/mol, XLogP of 3.96, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethoxyphenyl)-5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidine is sourced from PubChem (CID 131941843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).