6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine

C15H23N5 — CID 66132810

IUPAC6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cncn2CC)nc(CC)c1C
InChIInChI=1S/C15H23N5/c1-5-8-17-14-11(4)12(6-2)18-15(19-14)13-9-16-10-20(13)7-3/h9-10H,5-8H2,1-4H3,(H,17,18,19)
InChIKeyFRCGSTRHWBWYMD-UHFFFAOYSA-N
MW273.38 g/mol
LogP3.05
Rot. Bonds6

About 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine

6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine (PubChem CID 66132810) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
PubChem CID66132810
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine
SMILESCCCNc1nc(-c2cncn2CC)nc(CC)c1C
InChIInChI=1S/C15H23N5/c1-5-8-17-14-11(4)12(6-2)18-15(19-14)13-9-16-10-20(13)7-3/h9-10H,5-8H2,1-4H3,(H,17,18,19)
InChIKeyFRCGSTRHWBWYMD-UHFFFAOYSA-N
XLogP3.05
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine (CID 66132810) is 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine is CCCNc1nc(-c2cncn2CC)nc(CC)c1C.
What is the InChIKey of 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
The InChIKey is FRCGSTRHWBWYMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-5-8-17-14-11(4)12(6-2)18-15(19-14)13-9-16-10-20(13)7-3/h9-10H,5-8H2,1-4H3,(H,17,18,19).
What are the key properties of 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine?
6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(3-ethylimidazol-4-yl)-5-methyl-N-propylpyrimidin-4-amine is sourced from PubChem (CID 66132810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).