2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine

C14H17N3 — CID 62190972

IUPAC2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine
SMILESCNc1cc(C)nc(-c2cc(C)ccc2C)n1
InChIInChI=1S/C14H17N3/c1-9-5-6-10(2)12(7-9)14-16-11(3)8-13(15-4)17-14/h5-8H,1-4H3,(H,15,16,17)
InChIKeyIFWUXVJBAXRUHZ-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.11
Rot. Bonds2

About 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine

2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine (PubChem CID 62190972) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine
PubChem CID62190972
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine
SMILESCNc1cc(C)nc(-c2cc(C)ccc2C)n1
InChIInChI=1S/C14H17N3/c1-9-5-6-10(2)12(7-9)14-16-11(3)8-13(15-4)17-14/h5-8H,1-4H3,(H,15,16,17)
InChIKeyIFWUXVJBAXRUHZ-UHFFFAOYSA-N
XLogP3.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62319517
2-(2,5-dimethylphenyl)-5-iodo-N,6-dimethylpyrimidin-4-amine
CID 66295351
2-(2-bromo-5-chlorophenyl)-N,6-dimethylpyrimidin-4-amine
CID 66160131
2-(2-bromo-5-fluorophenyl)-N,6-dimethylpyrimidin-4-amine
CID 107923946
2-(2,5-dimethylphenyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-4-amine
CID 62203821
2-(5-fluoro-2-methylphenyl)-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62388957
N,6-dimethyl-2-(2-nitrophenyl)pyrimidin-4-amine
CID 62190534
2-(furan-2-yl)-N,6-dimethylpyrimidin-4-amine
CID 62190628
2-(2,4-dimethylphenyl)-6-(methoxymethyl)-N-methylpyrimidin-4-amine
CID 62320242
[2-(2-methoxy-4-methylphenyl)-6-methylpyrimidin-4-yl]hydrazine
CID 106793108
6-methyl-2-(2-methylphenyl)-N-propylpyrimidin-4-amine
CID 62192485
2-(4-methoxy-3-methylphenyl)-N,6-dimethylpyrimidin-4-amine
CID 62190799

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine?
The IUPAC name of 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine (CID 62190972) is 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine.
What is the SMILES notation for 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine?
The canonical SMILES for 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine is CNc1cc(C)nc(-c2cc(C)ccc2C)n1.
What is the InChIKey of 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine?
The InChIKey is IFWUXVJBAXRUHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-9-5-6-10(2)12(7-9)14-16-11(3)8-13(15-4)17-14/h5-8H,1-4H3,(H,15,16,17).
What are the key properties of 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine?
2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenyl)-N,6-dimethylpyrimidin-4-amine is sourced from PubChem (CID 62190972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).