2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine

C11H15N3 — CID 4568581

IUPAC2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine
SMILESCCc1nn2c(C)cc(C)nc2c1C
InChIInChI=1S/C11H15N3/c1-5-10-9(4)11-12-7(2)6-8(3)14(11)13-10/h6H,5H2,1-4H3
InChIKeyYZCCTZFECDDPKL-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.22
Rot. Bonds1

About 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine

2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine (PubChem CID 4568581) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine
PubChem CID4568581
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine
SMILESCCc1nn2c(C)cc(C)nc2c1C
InChIInChI=1S/C11H15N3/c1-5-10-9(4)11-12-7(2)6-8(3)14(11)13-10/h6H,5H2,1-4H3
InChIKeyYZCCTZFECDDPKL-UHFFFAOYSA-N
XLogP2.22
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine (CID 4568581) is 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine is CCc1nn2c(C)cc(C)nc2c1C.
What is the InChIKey of 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is YZCCTZFECDDPKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-5-10-9(4)11-12-7(2)6-8(3)14(11)13-10/h6H,5H2,1-4H3.
What are the key properties of 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 189.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3,5,7-trimethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 4568581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).