4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine

C13H19N5 — CID 114283486

IUPAC4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(-c2cnc(C)n2C)n1
InChIInChI=1S/C13H19N5/c1-5-6-14-13-16-9(2)7-11(17-13)12-8-15-10(3)18(12)4/h7-8H,5-6H2,1-4H3,(H,14,16,17)
InChIKeyVPUWOCIIQNIBDL-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.32
Rot. Bonds4

About 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine

4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine (PubChem CID 114283486) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine
PubChem CID114283486
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine
SMILESCCCNc1nc(C)cc(-c2cnc(C)n2C)n1
InChIInChI=1S/C13H19N5/c1-5-6-14-13-16-9(2)7-11(17-13)12-8-15-10(3)18(12)4/h7-8H,5-6H2,1-4H3,(H,14,16,17)
InChIKeyVPUWOCIIQNIBDL-UHFFFAOYSA-N
XLogP2.32
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,3-dimethylimidazol-4-yl)-N-propylpyrimidin-4-amine
CID 114283482
4-methyl-6-(2-propoxyphenyl)-N-propylpyrimidin-2-amine
CID 104663148
4-(4-cyclobutylphenyl)-6-methyl-N-propylpyrimidin-2-amine
CID 116506929
4-N-[(1,5-dimethylpyrazol-4-yl)methyl]-6-methyl-2-N-propylpyrimidine-2,4-diamine
CID 106041509
4-methyl-6-(1-methylpyrazol-4-yl)oxy-N-propylpyrimidin-2-amine
CID 116794496
4-(2,3-dimethylimidazol-4-yl)-6-methyl-2-[(2S)-1-methylpiperidin-2-yl]pyrimidine
CID 124976709
4-methyl-6-(1-methylpyrazol-4-yl)sulfanyl-N-propylpyrimidin-2-amine
CID 80891725
4-methyl-6-(3-methylbutan-2-yloxy)-N-propylpyrimidin-2-amine
CID 80882608
4-methyl-6-octoxy-N-propylpyrimidin-2-amine
CID 80862007
4-(2-methoxyethoxy)-6-methyl-N-propylpyrimidin-2-amine
CID 80858368
6-methyl-4-N-[2-(1-methylpyrazol-4-yl)ethyl]-2-N-propylpyrimidine-2,4-diamine
CID 80853005
4-N-cyclobutyl-6-methyl-2-N-propylpyrimidine-2,4-diamine
CID 80827135

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine?
The IUPAC name of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine (CID 114283486) is 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine.
What is the SMILES notation for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine?
The canonical SMILES for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine is CCCNc1nc(C)cc(-c2cnc(C)n2C)n1.
What is the InChIKey of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine?
The InChIKey is VPUWOCIIQNIBDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-5-6-14-13-16-9(2)7-11(17-13)12-8-15-10(3)18(12)4/h7-8H,5-6H2,1-4H3,(H,14,16,17).
What are the key properties of 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine?
4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine has a molecular weight of 245.33 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylimidazol-4-yl)-6-methyl-N-propylpyrimidin-2-amine is sourced from PubChem (CID 114283486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).