4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine

C14H17N3O2 — CID 116900544

IUPAC4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine
SMILESCNc1nccc(-c2ccc(OC)c(C)c2OC)n1
InChIInChI=1S/C14H17N3O2/c1-9-12(18-3)6-5-10(13(9)19-4)11-7-8-16-14(15-2)17-11/h5-8H,1-4H3,(H,15,16,17)
InChIKeyUIAUNQAUPYAYNA-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.51
Rot. Bonds4

About 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine

4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine (PubChem CID 116900544) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine
PubChem CID116900544
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine
SMILESCNc1nccc(-c2ccc(OC)c(C)c2OC)n1
InChIInChI=1S/C14H17N3O2/c1-9-12(18-3)6-5-10(13(9)19-4)11-7-8-16-14(15-2)17-11/h5-8H,1-4H3,(H,15,16,17)
InChIKeyUIAUNQAUPYAYNA-UHFFFAOYSA-N
XLogP2.51
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3-bromo-2,4-dimethoxyphenyl)-N-methylpyrimidin-2-amine
CID 103524050
[4-(4-methoxy-2,3-dimethylphenyl)pyrimidin-2-yl]hydrazine
CID 116904156
4-methoxy-3-[2-(methylamino)pyrimidin-4-yl]benzonitrile
CID 106951518
2-bromo-4-(2,4-dimethoxy-3-methylphenyl)-1,3-thiazole
CID 116968047
1-[6-(2,4-dimethoxy-3-methylphenyl)pyridazin-3-yl]-N-methylmethanamine
CID 95475627
5-(2,4-dimethoxy-3-methylphenyl)-N-methyl-1,3-oxazol-2-amine
CID 116832377
4-(2-ethoxyphenyl)-N-methylpyrimidin-2-amine
CID 63547712
4-(2-bromophenyl)-N-methylpyrimidin-2-amine
CID 63548579
4-(4,5-dimethoxy-2-methylphenyl)-2-methylpyrimidine
CID 116903924
5-(2,4-dimethoxy-3-methylphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827447
4-(2,4-dimethoxy-3-methylphenyl)-6-methylpyrimidine-2-carbonitrile
CID 116894919
4-(2,5-dimethoxy-3,4-dimethylphenyl)pyrimidine-2-carbonitrile
CID 116900932

Frequently Asked Questions

What is the IUPAC name of 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine?
The IUPAC name of 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine (CID 116900544) is 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine?
The canonical SMILES for 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine is CNc1nccc(-c2ccc(OC)c(C)c2OC)n1.
What is the InChIKey of 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine?
The InChIKey is UIAUNQAUPYAYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-12(18-3)6-5-10(13(9)19-4)11-7-8-16-14(15-2)17-11/h5-8H,1-4H3,(H,15,16,17).
What are the key properties of 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine?
4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine has a molecular weight of 259.31 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,4-dimethoxy-3-methylphenyl)-N-methylpyrimidin-2-amine is sourced from PubChem (CID 116900544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).