5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine

C13H15N3O — CID 15280859

IUPAC5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine
SMILESCOc1cccc(-c2c(C)nc(C)nc2N)c1
InChIInChI=1S/C13H15N3O/c1-8-12(13(14)16-9(2)15-8)10-5-4-6-11(7-10)17-3/h4-7H,1-3H3,(H2,14,15,16)
InChIKeyIVOXCGCLXASKKK-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.35
Rot. Bonds2

About 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine

5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine (PubChem CID 15280859) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine
PubChem CID15280859
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine
SMILESCOc1cccc(-c2c(C)nc(C)nc2N)c1
InChIInChI=1S/C13H15N3O/c1-8-12(13(14)16-9(2)15-8)10-5-4-6-11(7-10)17-3/h4-7H,1-3H3,(H2,14,15,16)
InChIKeyIVOXCGCLXASKKK-UHFFFAOYSA-N
XLogP2.35
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,5-dimethoxyphenyl)-2,6-dimethylpyrimidin-4-amine
CID 82301068
6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
CID 124908703
3,5-difluoro-4-(3-methoxyphenyl)aniline
CID 175669991
4-(3-methoxyphenyl)pyridine-2,6-diamine
CID 18313645
4-(3-methoxyphenyl)-2,6-dimethylpyrimidine
CID 116897003
2,3,5,6-tetrakis(3-methoxyphenyl)pyrazine
CID 132941107
6-(3-methoxyphenyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80974789
2-(3-methoxyphenyl)-1,3,5-trimethylbenzene
CID 66916575
azane;1-methoxy-3-(3-methoxyphenyl)benzene
CID 174719266
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762
5-(3-aminophenyl)-6-methylpyrimidine-2,4-diamine
CID 67199242
2-[4-(3-methoxyphenyl)-3,5-dimethylpyrazol-1-yl]ethanamine
CID 82479065

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine?
The IUPAC name of 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine (CID 15280859) is 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine?
The canonical SMILES for 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine is COc1cccc(-c2c(C)nc(C)nc2N)c1.
What is the InChIKey of 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine?
The InChIKey is IVOXCGCLXASKKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-8-12(13(14)16-9(2)15-8)10-5-4-6-11(7-10)17-3/h4-7H,1-3H3,(H2,14,15,16).
What are the key properties of 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine?
5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine has a molecular weight of 229.28 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxyphenyl)-2,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 15280859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).