2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine

C16H20N6 — CID 126947537

IUPAC2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESCc1cnn(C2CCN(c3cc(C)nc4cc(C)nn34)C2)c1
InChIInChI=1S/C16H20N6/c1-11-8-17-21(9-11)14-4-5-20(10-14)16-7-12(2)18-15-6-13(3)19-22(15)16/h6-9,14H,4-5,10H2,1-3H3
InChIKeyVHJKCZTUMISBFP-UHFFFAOYSA-N
MW296.38 g/mol
LogP2.30
Rot. Bonds2

About 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine

2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine (PubChem CID 126947537) has the molecular formula C16H20N6 and a molecular weight of 296.38 g/mol. Its IUPAC name is 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine
PubChem CID126947537
Molecular FormulaC16H20N6
Molecular Weight296.38 g/mol
Exact Mass296.17
IUPAC Name2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine
SMILESCc1cnn(C2CCN(c3cc(C)nc4cc(C)nn34)C2)c1
InChIInChI=1S/C16H20N6/c1-11-8-17-21(9-11)14-4-5-20(10-14)16-7-12(2)18-15-6-13(3)19-22(15)16/h6-9,14H,4-5,10H2,1-3H3
InChIKeyVHJKCZTUMISBFP-UHFFFAOYSA-N
XLogP2.30
TPSA51.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.38
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[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

Related Compounds

(3S)-1-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-3-ol
CID 164640132
1-[1-[1-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)azetidin-3-yl]pyrazol-4-yl]pyrrolidin-2-one
CID 126945585
7-[3-(fluoromethyl)piperidin-1-yl]-2,5-dimethylpyrazolo[1,5-a]pyrimidine
CID 155941691
[1-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]-thiomorpholin-4-ylmethanone
CID 165432476
4-methyl-1-(1-methylpyrrolidin-3-yl)pyrazole
CID 70661033
2-methyl-3-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]quinoxaline
CID 126947305
2-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]-6-(1,2,4-triazol-1-yl)pyrazine
CID 126947503
1-[1-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)piperidin-4-yl]-4-(methylsulfonylmethyl)pyrrolidin-2-one
CID 126900033
2-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]quinoxaline
CID 126947471
[2-methyl-6-[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-4-pyridinyl]methanol
CID 138033464
1-(1-cyclopentylpyrrolidin-3-yl)-4-methylpyrazole
CID 126947275
[4-(2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl)morpholin-2-yl]-piperidin-1-ylmethanone
CID 163343507

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine (CID 126947537) is 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine is Cc1cnn(C2CCN(c3cc(C)nc4cc(C)nn34)C2)c1.
What is the InChIKey of 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is VHJKCZTUMISBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6/c1-11-8-17-21(9-11)14-4-5-20(10-14)16-7-12(2)18-15-6-13(3)19-22(15)16/h6-9,14H,4-5,10H2,1-3H3.
What are the key properties of 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine?
2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 296.38 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-7-[3-(4-methylpyrazol-1-yl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 126947537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).