4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine

C15H19N3O3 — CID 80865640

IUPAC4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(Oc2c(OC)cccc2OC)n1
InChIInChI=1S/C15H19N3O3/c1-5-16-15-17-10(2)9-13(18-15)21-14-11(19-3)7-6-8-12(14)20-4/h6-9H,5H2,1-4H3,(H,16,17,18)
InChIKeyCBGIQRQTMJJHQK-UHFFFAOYSA-N
MW289.34 g/mol
LogP3.03
Rot. Bonds6

About 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine

4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine (PubChem CID 80865640) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
PubChem CID80865640
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(Oc2c(OC)cccc2OC)n1
InChIInChI=1S/C15H19N3O3/c1-5-16-15-17-10(2)9-13(18-15)21-14-11(19-3)7-6-8-12(14)20-4/h6-9H,5H2,1-4H3,(H,16,17,18)
InChIKeyCBGIQRQTMJJHQK-UHFFFAOYSA-N
XLogP3.03
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-ethyl-4-(3-methoxyphenoxy)-6-methylpyrimidin-2-amine
CID 80864633
N-ethyl-4-(3-fluorophenoxy)-6-methylpyrimidin-2-amine
CID 80869023
4-(3,5-dimethylphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80864393
4-(4-bromo-2-methylphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80879089
3-[2-(ethylamino)-6-methylpyrimidin-4-yl]oxybenzonitrile
CID 80863077
N-ethyl-4-methyl-6-(2,3,5-trimethylphenoxy)pyrimidin-2-amine
CID 80881926
4-(3,5-dichlorophenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80874616
4-[(3-bromophenyl)methoxy]-N-ethyl-6-methylpyrimidin-2-amine
CID 82826004
4-(2-methoxy-4-methylphenoxy)-6-methyl-N-propylpyrimidin-2-amine
CID 80874328
N-ethyl-4-hexoxy-6-methylpyrimidin-2-amine
CID 80861146
4-(2-ethylphenoxy)-6-methyl-N-propylpyrimidin-2-amine
CID 80875948
N-[4-[[2-(ethylamino)-6-methylpyrimidin-4-yl]amino]phenyl]-2,3-dimethoxybenzamide
CID 122325626

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine?
The IUPAC name of 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine (CID 80865640) is 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine?
The canonical SMILES for 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine is CCNc1nc(C)cc(Oc2c(OC)cccc2OC)n1.
What is the InChIKey of 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine?
The InChIKey is CBGIQRQTMJJHQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-5-16-15-17-10(2)9-13(18-15)21-14-11(19-3)7-6-8-12(14)20-4/h6-9H,5H2,1-4H3,(H,16,17,18).
What are the key properties of 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine?
4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethoxyphenoxy)-N-ethyl-6-methylpyrimidin-2-amine is sourced from PubChem (CID 80865640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).