2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine

C13H19N3 — CID 157107180

IUPAC2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1nc2c(C)c(C)nn2c(C)c1C(C)C
InChIInChI=1S/C13H19N3/c1-7(2)12-10(5)14-13-8(3)9(4)15-16(13)11(12)6/h7H,1-6H3
InChIKeyRVSBVGONMNNKDR-UHFFFAOYSA-N
MW217.32 g/mol
LogP3.09
Rot. Bonds1

About 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine

2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 157107180) has the molecular formula C13H19N3 and a molecular weight of 217.32 g/mol. Its IUPAC name is 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID157107180
Molecular FormulaC13H19N3
Molecular Weight217.32 g/mol
Exact Mass217.16
IUPAC Name2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1nc2c(C)c(C)nn2c(C)c1C(C)C
InChIInChI=1S/C13H19N3/c1-7(2)12-10(5)14-13-8(3)9(4)15-16(13)11(12)6/h7H,1-6H3
InChIKeyRVSBVGONMNNKDR-UHFFFAOYSA-N
XLogP3.09
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.32
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine (CID 157107180) is 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine is Cc1nc2c(C)c(C)nn2c(C)c1C(C)C.
What is the InChIKey of 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is RVSBVGONMNNKDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3/c1-7(2)12-10(5)14-13-8(3)9(4)15-16(13)11(12)6/h7H,1-6H3.
What are the key properties of 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine?
2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 217.32 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,7-tetramethyl-6-propan-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 157107180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).