1-cyclopropylpyrazol-4-ol

C6H8N2O — CID 117124803

IUPAC1-cyclopropylpyrazol-4-ol
SMILESOc1cnn(C2CC2)c1
InChIInChI=1S/C6H8N2O/c9-6-3-7-8(4-6)5-1-2-5/h3-5,9H,1-2H2
InChIKeyFOLFJWGZNWRJLM-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.92
Rot. Bonds1

About 1-cyclopropylpyrazol-4-ol

1-cyclopropylpyrazol-4-ol (PubChem CID 117124803) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is 1-cyclopropylpyrazol-4-ol.

Molecular Properties

Compound Name1-cyclopropylpyrazol-4-ol
PubChem CID117124803
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC Name1-cyclopropylpyrazol-4-ol
SMILESOc1cnn(C2CC2)c1
InChIInChI=1S/C6H8N2O/c9-6-3-7-8(4-6)5-1-2-5/h3-5,9H,1-2H2
InChIKeyFOLFJWGZNWRJLM-UHFFFAOYSA-N
XLogP0.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylpyrazol-4-ol?
The IUPAC name of 1-cyclopropylpyrazol-4-ol (CID 117124803) is 1-cyclopropylpyrazol-4-ol.
What is the SMILES notation for 1-cyclopropylpyrazol-4-ol?
The canonical SMILES for 1-cyclopropylpyrazol-4-ol is Oc1cnn(C2CC2)c1.
What is the InChIKey of 1-cyclopropylpyrazol-4-ol?
The InChIKey is FOLFJWGZNWRJLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c9-6-3-7-8(4-6)5-1-2-5/h3-5,9H,1-2H2.
What are the key properties of 1-cyclopropylpyrazol-4-ol?
1-cyclopropylpyrazol-4-ol has a molecular weight of 124.14 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylpyrazol-4-ol is sourced from PubChem (CID 117124803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).