5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine

C8H11N5 — CID 5185008

IUPAC5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine
SMILESCc1cc(C)n2nc(N)c(N)c2n1
InChIInChI=1S/C8H11N5/c1-4-3-5(2)13-8(11-4)6(9)7(10)12-13/h3H,9H2,1-2H3,(H2,10,12)
InChIKeyUWPZIUVTJBGBCD-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.51
Rot. Bonds

About 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine

5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine (PubChem CID 5185008) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine.

Molecular Properties

Compound Name5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine
PubChem CID5185008
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine
SMILESCc1cc(C)n2nc(N)c(N)c2n1
InChIInChI=1S/C8H11N5/c1-4-3-5(2)13-8(11-4)6(9)7(10)12-13/h3H,9H2,1-2H3,(H2,10,12)
InChIKeyUWPZIUVTJBGBCD-UHFFFAOYSA-N
XLogP0.51
TPSA82.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine?
The IUPAC name of 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine (CID 5185008) is 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine.
What is the SMILES notation for 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine?
The canonical SMILES for 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine is Cc1cc(C)n2nc(N)c(N)c2n1.
What is the InChIKey of 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine?
The InChIKey is UWPZIUVTJBGBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-4-3-5(2)13-8(11-4)6(9)7(10)12-13/h3H,9H2,1-2H3,(H2,10,12).
What are the key properties of 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine?
5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine has a molecular weight of 177.21 g/mol, XLogP of 0.51, 0 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethylpyrazolo[1,5-a]pyrimidine-2,3-diamine is sourced from PubChem (CID 5185008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).