6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine

C14H17N3O2 — CID 80867778

IUPAC6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine
SMILESCNc1ncnc(OCc2cccc(OC)c2)c1C
InChIInChI=1S/C14H17N3O2/c1-10-13(15-2)16-9-17-14(10)19-8-11-5-4-6-12(7-11)18-3/h4-7,9H,8H2,1-3H3,(H,15,16,17)
InChIKeySDPMHKPEJDWFEV-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.41
Rot. Bonds5

About 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine

6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine (PubChem CID 80867778) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine
PubChem CID80867778
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine
SMILESCNc1ncnc(OCc2cccc(OC)c2)c1C
InChIInChI=1S/C14H17N3O2/c1-10-13(15-2)16-9-17-14(10)19-8-11-5-4-6-12(7-11)18-3/h4-7,9H,8H2,1-3H3,(H,15,16,17)
InChIKeySDPMHKPEJDWFEV-UHFFFAOYSA-N
XLogP2.41
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[6-[(3-methoxyphenyl)methoxy]-5-nitropyrimidin-4-yl]hydrazine
CID 80906474
5-ethyl-6-[3-(methoxymethyl)phenoxy]-N-methylpyrimidin-4-amine
CID 80876118
4-[(3-methoxyphenyl)methoxy]-N-methylaniline
CID 39205064
4-methoxy-6-[(3-methoxyphenyl)methoxy]-N-methyl-1,3,5-triazin-2-amine
CID 80868535
5-ethyl-6-[(4-methoxyphenyl)methoxy]-N-methylpyrimidin-4-amine
CID 80867429
6-(2-methoxyethoxy)-N,5-dimethylpyrimidin-4-amine
CID 80859076
6-[(3-chlorophenyl)methoxy]-5-ethyl-N-methylpyrimidin-4-amine
CID 80876248
2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 24708484
6-[(3-methoxyphenyl)methoxy]pyrimidin-4-amine
CID 80868695
6-methoxy-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 66327861
1-methoxy-3-[(2-methylphenoxy)methyl]benzene
CID 59416569
N-[3-(chloromethyl)phenyl]-6-methoxy-5-methylpyrimidin-4-amine
CID 66324701

Frequently Asked Questions

What is the IUPAC name of 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine (CID 80867778) is 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine is CNc1ncnc(OCc2cccc(OC)c2)c1C.
What is the InChIKey of 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine?
The InChIKey is SDPMHKPEJDWFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-13(15-2)16-9-17-14(10)19-8-11-5-4-6-12(7-11)18-3/h4-7,9H,8H2,1-3H3,(H,15,16,17).
What are the key properties of 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine?
6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine has a molecular weight of 259.31 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-methoxyphenyl)methoxy]-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 80867778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).