6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine

C15H19N3 — CID 80945175

IUPAC6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(-c2cc(C)ccc2C)n1
InChIInChI=1S/C15H19N3/c1-4-5-15-17-13(9-14(16)18-15)12-8-10(2)6-7-11(12)3/h6-9H,4-5H2,1-3H3,(H2,16,17,18)
InChIKeyMUXCATQGUAGRNA-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.30
Rot. Bonds3

About 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine

6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine (PubChem CID 80945175) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine
PubChem CID80945175
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)cc(-c2cc(C)ccc2C)n1
InChIInChI=1S/C15H19N3/c1-4-5-15-17-13(9-14(16)18-15)12-8-10(2)6-7-11(12)3/h6-9H,4-5H2,1-3H3,(H2,16,17,18)
InChIKeyMUXCATQGUAGRNA-UHFFFAOYSA-N
XLogP3.30
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine (CID 80945175) is 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine is CCCc1nc(N)cc(-c2cc(C)ccc2C)n1.
What is the InChIKey of 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine?
The InChIKey is MUXCATQGUAGRNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-4-5-15-17-13(9-14(16)18-15)12-8-10(2)6-7-11(12)3/h6-9H,4-5H2,1-3H3,(H2,16,17,18).
What are the key properties of 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine?
6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylphenyl)-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80945175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).