4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine

C15H17ClN2O2 — CID 63549144

IUPAC4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine
SMILESCCc1nc(-c2ccc(OC)cc2OC)nc(Cl)c1C
InChIInChI=1S/C15H17ClN2O2/c1-5-12-9(2)14(16)18-15(17-12)11-7-6-10(19-3)8-13(11)20-4/h6-8H,5H2,1-4H3
InChIKeyFFXQLWGVJBWRKO-UHFFFAOYSA-N
MW292.77 g/mol
LogP3.69
Rot. Bonds4

About 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine

4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine (PubChem CID 63549144) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine.

Molecular Properties

Compound Name4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine
PubChem CID63549144
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine
SMILESCCc1nc(-c2ccc(OC)cc2OC)nc(Cl)c1C
InChIInChI=1S/C15H17ClN2O2/c1-5-12-9(2)14(16)18-15(17-12)11-7-6-10(19-3)8-13(11)20-4/h6-8H,5H2,1-4H3
InChIKeyFFXQLWGVJBWRKO-UHFFFAOYSA-N
XLogP3.69
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 63560270
2-(2,4-dimethoxyphenyl)-4-ethyl-6-methoxypyrimidin-5-amine
CID 22324338
4-chloro-2-(2,4-dimethoxyphenyl)-6-propylpyrimidine
CID 43557702
2-(2-bromophenyl)-4-chloro-6-ethyl-5-methylpyrimidine
CID 63549132
5-(2,4-dimethoxyphenyl)-2H-tetrazole
CID 82077250
5-chloro-3-(2,4-dimethoxyphenyl)-1,2,4-triazine
CID 116823727
4-chloro-2-(3,5-dimethylphenyl)-6-ethyl-5-methylpyrimidine
CID 63549645
N-(cyclopropylmethyl)-2-(2,4-dimethoxyphenyl)-4-ethyl-6-methoxy-N-propylpyrimidin-5-amine
CID 22324323
4-chloro-2-(3-ethoxyphenyl)-6-ethyl-5-methylpyrimidine
CID 55247750
[2-(2,4-dimethoxyphenyl)-6-methylpyrimidin-4-yl]hydrazine
CID 62250716
5-bromo-4-chloro-2-(2,5-dimethoxyphenyl)-6-methylpyrimidine
CID 66313783
5-cyclopropyl-3-(2,4-dimethoxyphenyl)-1H-1,2,4-triazole
CID 61336548

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine?
The IUPAC name of 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine (CID 63549144) is 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine.
What is the SMILES notation for 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine?
The canonical SMILES for 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine is CCc1nc(-c2ccc(OC)cc2OC)nc(Cl)c1C.
What is the InChIKey of 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine?
The InChIKey is FFXQLWGVJBWRKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-5-12-9(2)14(16)18-15(17-12)11-7-6-10(19-3)8-13(11)20-4/h6-8H,5H2,1-4H3.
What are the key properties of 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine?
4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine has a molecular weight of 292.77 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(2,4-dimethoxyphenyl)-6-ethyl-5-methylpyrimidine is sourced from PubChem (CID 63549144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).