5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine

C14H17N3 — CID 115503502

IUPAC5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
SMILESCc1cc(C)c(-c2ncnc(N)c2C)c(C)c1
InChIInChI=1S/C14H17N3/c1-8-5-9(2)12(10(3)6-8)13-11(4)14(15)17-7-16-13/h5-7H,1-4H3,(H2,15,16,17)
InChIKeyHQBHSIZXDQYREA-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.96
Rot. Bonds1

About 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine

5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine (PubChem CID 115503502) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
PubChem CID115503502
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
SMILESCc1cc(C)c(-c2ncnc(N)c2C)c(C)c1
InChIInChI=1S/C14H17N3/c1-8-5-9(2)12(10(3)6-8)13-11(4)14(15)17-7-16-13/h5-7H,1-4H3,(H2,15,16,17)
InChIKeyHQBHSIZXDQYREA-UHFFFAOYSA-N
XLogP2.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,5-dimethyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 113324602
5-methoxy-6-(2-methoxy-4,6-dimethylphenyl)pyrimidin-4-amine
CID 106681516
6-(2-methoxy-4,6-dimethylphenyl)-5-nitropyrimidin-4-amine
CID 106681492
5-methyl-4-(2,4,6-trimethylphenyl)-1H-pyrimidin-6-one
CID 136769791
5-methyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-amine
CID 82113707
6-(2-chloro-5-fluorophenyl)-5-methylpyrimidin-4-amine
CID 105396086
6-fluoro-5-methylpyrimidin-4-amine
CID 44558106
N-methyl-5-propyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine
CID 115503443
3-bromo-2-(2,4,6-trimethylphenyl)pyridine
CID 160653296
6-[4-(1-methoxyethyl)phenyl]-5-methylpyrimidin-4-amine
CID 119066119
7-methyl-5H-pyrrolo[3,4-d]pyrimidin-4-amine
CID 158526538
[4-(2,4,6-trimethylphenyl)-1,3-oxazol-5-yl]methanamine
CID 82127074

Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The IUPAC name of 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine (CID 115503502) is 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The canonical SMILES for 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine is Cc1cc(C)c(-c2ncnc(N)c2C)c(C)c1.
What is the InChIKey of 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
The InChIKey is HQBHSIZXDQYREA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-8-5-9(2)12(10(3)6-8)13-11(4)14(15)17-7-16-13/h5-7H,1-4H3,(H2,15,16,17).
What are the key properties of 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine?
5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine has a molecular weight of 227.31 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-(2,4,6-trimethylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 115503502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).