2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine

C15H19N3O3 — CID 62318946

IUPAC2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(COC)nc(-c2ccc(OC)c(OC)c2)n1
InChIInChI=1S/C15H19N3O3/c1-16-14-8-11(9-19-2)17-15(18-14)10-5-6-12(20-3)13(7-10)21-4/h5-8H,9H2,1-4H3,(H,16,17,18)
InChIKeyVWWPWOAKCYCORO-UHFFFAOYSA-N
MW289.34 g/mol
LogP2.35
Rot. Bonds6

About 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine

2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine (PubChem CID 62318946) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
PubChem CID62318946
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
SMILESCNc1cc(COC)nc(-c2ccc(OC)c(OC)c2)n1
InChIInChI=1S/C15H19N3O3/c1-16-14-8-11(9-19-2)17-15(18-14)10-5-6-12(20-3)13(7-10)21-4/h5-8H,9H2,1-4H3,(H,16,17,18)
InChIKeyVWWPWOAKCYCORO-UHFFFAOYSA-N
XLogP2.35
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 ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-chloro-4-methoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 65022275
2-(3-chloro-4-fluorophenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 63087865
2-(3-chlorophenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 55062778
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62318591
6-(methoxymethyl)-N-methyl-2-(4-propan-2-yloxyphenyl)pyrimidin-4-amine
CID 62318785
2-(3-cyclopropylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 79980046
6-cyclopropyl-2-(3,4-dimethoxyphenyl)-N-methylpyrimidin-4-amine
CID 63353878
2-(4-methoxy-3-methylphenyl)-N,6-dimethylpyrimidin-4-amine
CID 62190799
2-(2,4-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62320242
2-(2,5-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62319517
2-(4-fluoro-3-methoxyphenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 107922852
2-(3-chloro-4-methoxyphenyl)-N,6-dimethylpyrimidin-4-amine
CID 65022234

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine (CID 62318946) is 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine is CNc1cc(COC)nc(-c2ccc(OC)c(OC)c2)n1.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine?
The InChIKey is VWWPWOAKCYCORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-16-14-8-11(9-19-2)17-15(18-14)10-5-6-12(20-3)13(7-10)21-4/h5-8H,9H2,1-4H3,(H,16,17,18).
What are the key properties of 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine?
2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine has a molecular weight of 289.34 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 62318946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).