6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine

C15H23N5 — CID 80992252

IUPAC6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-n2nc(C)c(CC)c2C)n1
InChIInChI=1S/C15H23N5/c1-6-8-13-17-14(16)9(3)15(18-13)20-11(5)12(7-2)10(4)19-20/h6-8H2,1-5H3,(H2,16,17,18)
InChIKeyMYSMSMMEPRVBDJ-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.68
Rot. Bonds4

About 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine

6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine (PubChem CID 80992252) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine
PubChem CID80992252
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine
SMILESCCCc1nc(N)c(C)c(-n2nc(C)c(CC)c2C)n1
InChIInChI=1S/C15H23N5/c1-6-8-13-17-14(16)9(3)15(18-13)20-11(5)12(7-2)10(4)19-20/h6-8H2,1-5H3,(H2,16,17,18)
InChIKeyMYSMSMMEPRVBDJ-UHFFFAOYSA-N
XLogP2.68
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine?
The IUPAC name of 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine (CID 80992252) is 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine?
The canonical SMILES for 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine is CCCc1nc(N)c(C)c(-n2nc(C)c(CC)c2C)n1.
What is the InChIKey of 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine?
The InChIKey is MYSMSMMEPRVBDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-6-8-13-17-14(16)9(3)15(18-13)20-11(5)12(7-2)10(4)19-20/h6-8H2,1-5H3,(H2,16,17,18).
What are the key properties of 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine?
6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine has a molecular weight of 273.38 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethyl-3,5-dimethylpyrazol-1-yl)-5-methyl-2-propylpyrimidin-4-amine is sourced from PubChem (CID 80992252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).