2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine

C14H17N3O — CID 62318956

IUPAC2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine
SMILESCOCc1cc(N)nc(-c2ccc(C)cc2C)n1
InChIInChI=1S/C14H17N3O/c1-9-4-5-12(10(2)6-9)14-16-11(8-18-3)7-13(15)17-14/h4-7H,8H2,1-3H3,(H2,15,16,17)
InChIKeySBKLTJDBCGXHQJ-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.49
Rot. Bonds3

About 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine

2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine (PubChem CID 62318956) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine
PubChem CID62318956
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine
SMILESCOCc1cc(N)nc(-c2ccc(C)cc2C)n1
InChIInChI=1S/C14H17N3O/c1-9-4-5-12(10(2)6-9)14-16-11(8-18-3)7-13(15)17-14/h4-7H,8H2,1-3H3,(H2,15,16,17)
InChIKeySBKLTJDBCGXHQJ-UHFFFAOYSA-N
XLogP2.49
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-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

2-(2,4-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62320242
2-(2,4-dichlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 62319145
2-(2-bromo-4-fluorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 107281410
6-(methoxymethyl)-2-(3-methylthiophen-2-yl)pyrimidin-4-amine
CID 62320799
6-(methoxymethyl)-2-(4-methoxyphenyl)pyrimidin-4-amine
CID 62319679
2-(2,4-dimethylphenyl)-6-propan-2-ylpyrimidin-4-amine
CID 55045645
6-(methoxymethyl)-2-(6-methyl-2-pyridinyl)pyrimidin-4-amine
CID 63554209
2-(2-methoxy-4-methylphenyl)-6-propylpyrimidin-4-amine
CID 106793002
2-(2-bromo-5-chlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 66161513
2-(4-fluorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 55062587
2-(3,4-dichlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 62320412
2-(2,5-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62319517

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine?
The IUPAC name of 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine (CID 62318956) is 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine?
The canonical SMILES for 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine is COCc1cc(N)nc(-c2ccc(C)cc2C)n1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine?
The InChIKey is SBKLTJDBCGXHQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-4-5-12(10(2)6-9)14-16-11(8-18-3)7-13(15)17-14/h4-7H,8H2,1-3H3,(H2,15,16,17).
What are the key properties of 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine?
2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine has a molecular weight of 243.31 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-6-(methoxymethyl)pyrimidin-4-amine is sourced from PubChem (CID 62318956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).