2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine

C11H15N3 — CID 18684973

IUPAC2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine
SMILESCc1nc2c(C)c(C)nn2c(C)c1C
InChIInChI=1S/C11H15N3/c1-6-8(3)12-11-7(2)9(4)13-14(11)10(6)5/h1-5H3
InChIKeyXZRMIZIUMKPIMG-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.27
Rot. Bonds

About 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine

2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine (PubChem CID 18684973) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine
PubChem CID18684973
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine
SMILESCc1nc2c(C)c(C)nn2c(C)c1C
InChIInChI=1S/C11H15N3/c1-6-8(3)12-11-7(2)9(4)13-14(11)10(6)5/h1-5H3
InChIKeyXZRMIZIUMKPIMG-UHFFFAOYSA-N
XLogP2.27
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine (CID 18684973) is 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine is Cc1nc2c(C)c(C)nn2c(C)c1C.
What is the InChIKey of 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is XZRMIZIUMKPIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-6-8(3)12-11-7(2)9(4)13-14(11)10(6)5/h1-5H3.
What are the key properties of 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine?
2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 189.26 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6,7-pentamethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 18684973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).