5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

C11H15N5 — CID 136709565

IUPAC5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESCC1CCn2nc(-c3nccn3C)cc2N1
InChIInChI=1S/C11H15N5/c1-8-3-5-16-10(13-8)7-9(14-16)11-12-4-6-15(11)2/h4,6-8,13H,3,5H2,1-2H3
InChIKeyCYJUEAVAJVGDKT-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.49
Rot. Bonds1

About 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (PubChem CID 136709565) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
PubChem CID136709565
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESCC1CCn2nc(-c3nccn3C)cc2N1
InChIInChI=1S/C11H15N5/c1-8-3-5-16-10(13-8)7-9(14-16)11-12-4-6-15(11)2/h4,6-8,13H,3,5H2,1-2H3
InChIKeyCYJUEAVAJVGDKT-UHFFFAOYSA-N
XLogP1.49
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The IUPAC name of 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (CID 136709565) is 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is CC1CCn2nc(-c3nccn3C)cc2N1.
What is the InChIKey of 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The InChIKey is CYJUEAVAJVGDKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-3-5-16-10(13-8)7-9(14-16)11-12-4-6-15(11)2/h4,6-8,13H,3,5H2,1-2H3.
What are the key properties of 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine has a molecular weight of 217.28 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(1-methylimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 136709565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).