2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine

C13H15N5 — CID 56673919

IUPAC2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(C)n2nc(-n3nc(C)cc3C)cc2n1
InChIInChI=1S/C13H15N5/c1-8-5-10(3)17-12(14-8)7-13(16-17)18-11(4)6-9(2)15-18/h5-7H,1-4H3
InChIKeyBJFZJSOSNBCIEB-UHFFFAOYSA-N
MW241.30 g/mol
LogP2.15
Rot. Bonds1

About 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine

2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine (PubChem CID 56673919) has the molecular formula C13H15N5 and a molecular weight of 241.30 g/mol. Its IUPAC name is 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
PubChem CID56673919
Molecular FormulaC13H15N5
Molecular Weight241.30 g/mol
Exact Mass241.13
IUPAC Name2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
SMILESCc1cc(C)n2nc(-n3nc(C)cc3C)cc2n1
InChIInChI=1S/C13H15N5/c1-8-5-10(3)17-12(14-8)7-13(16-17)18-11(4)6-9(2)15-18/h5-7H,1-4H3
InChIKeyBJFZJSOSNBCIEB-UHFFFAOYSA-N
XLogP2.15
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.30
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5,7-Dimethyl(1,2,4)triazolo(1,5-a)pyrimidine
CID 24356
Pyrazolo(1,5-a)pyrimidine, 5,7-dimethyl-
CID 215186
3-Bromo-5,7-dimethylpyrazolo(1,5-a)pyrimidine
CID 198235
5,7-Dimethyltetrazolo(1,5-a)pyrimidine
CID 229014
Pyrazolo(1.5-a)pyrimidine, 5,7-dimethyl-3-iodo-
CID 206164
2-[2-(5-azetidin-1-yl-2-methyl-2H-[1,2,4]triazol-3-yl)-ethyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 72704534
5,7-Dimethylpyrazolo[1,5-a]pyrimidin-2-amine
CID 28063903
5,7-Dimethyl-(1,2,4)triazolo(1,5-a)pyrimidin-2-amine
CID 267310
2-(3,5-Dimethyl-pyrazol-1-YL)-4,6-dimethyl-pyrimidine
CID 3401968
2,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 3611062
6-(3,5-Dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 909959
6-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-methyl-1,2,4-triazolo[4,3-b][1,2,5,6]tetrazine
CID 578661

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine (CID 56673919) is 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine is Cc1cc(C)n2nc(-n3nc(C)cc3C)cc2n1.
What is the InChIKey of 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is BJFZJSOSNBCIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5/c1-8-5-10(3)17-12(14-8)7-13(16-17)18-11(4)6-9(2)15-18/h5-7H,1-4H3.
What are the key properties of 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine?
2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 241.30 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 56673919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).