2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine

C9H11N5 — CID 58034777

IUPAC2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine
SMILESNc1cnc2cc(C3CC3)nn2c1N
InChIInChI=1S/C9H11N5/c10-6-4-12-8-3-7(5-1-2-5)13-14(8)9(6)11/h3-5H,1-2,10-11H2
InChIKeyHTRYYCLNNTUAFH-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.77
Rot. Bonds1

About 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine

2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine (PubChem CID 58034777) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine.

Molecular Properties

Compound Name2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine
PubChem CID58034777
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine
SMILESNc1cnc2cc(C3CC3)nn2c1N
InChIInChI=1S/C9H11N5/c10-6-4-12-8-3-7(5-1-2-5)13-14(8)9(6)11/h3-5H,1-2,10-11H2
InChIKeyHTRYYCLNNTUAFH-UHFFFAOYSA-N
XLogP0.77
TPSA82.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine?
The IUPAC name of 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine (CID 58034777) is 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine.
What is the SMILES notation for 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine?
The canonical SMILES for 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine is Nc1cnc2cc(C3CC3)nn2c1N.
What is the InChIKey of 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine?
The InChIKey is HTRYYCLNNTUAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c10-6-4-12-8-3-7(5-1-2-5)13-14(8)9(6)11/h3-5H,1-2,10-11H2.
What are the key properties of 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine?
2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine has a molecular weight of 189.22 g/mol, XLogP of 0.77, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylpyrazolo[1,5-a]pyrimidine-6,7-diamine is sourced from PubChem (CID 58034777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).