2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

C15H23N5 — CID 136847670

IUPAC2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESCn1nccc1C1CCNc2cc(CC(C)(C)C)nn21
InChIInChI=1S/C15H23N5/c1-15(2,3)10-11-9-14-16-7-5-13(20(14)18-11)12-6-8-17-19(12)4/h6,8-9,13,16H,5,7,10H2,1-4H3
InChIKeySAKIUMUWDYAVRN-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.61
Rot. Bonds2

About 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (PubChem CID 136847670) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
PubChem CID136847670
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine
SMILESCn1nccc1C1CCNc2cc(CC(C)(C)C)nn21
InChIInChI=1S/C15H23N5/c1-15(2,3)10-11-9-14-16-7-5-13(20(14)18-11)12-6-8-17-19(12)4/h6,8-9,13,16H,5,7,10H2,1-4H3
InChIKeySAKIUMUWDYAVRN-UHFFFAOYSA-N
XLogP2.61
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine (CID 136847670) is 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is Cn1nccc1C1CCNc2cc(CC(C)(C)C)nn21.
What is the InChIKey of 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
The InChIKey is SAKIUMUWDYAVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-15(2,3)10-11-9-14-16-7-5-13(20(14)18-11)12-6-8-17-19(12)4/h6,8-9,13,16H,5,7,10H2,1-4H3.
What are the key properties of 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine?
2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine has a molecular weight of 273.38 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-7-(2-methylpyrazol-3-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 136847670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).