1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole

C12H11FN2 — CID 158250793

IUPAC1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole
SMILESFc1ccc(-n2ncc3c2CCC3)cc1
InChIInChI=1S/C12H11FN2/c13-10-4-6-11(7-5-10)15-12-3-1-2-9(12)8-14-15/h4-8H,1-3H2
InChIKeyAZNYUESQYNDCQU-UHFFFAOYSA-N
MW202.23 g/mol
LogP2.50
Rot. Bonds1

About 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole

1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole (PubChem CID 158250793) has the molecular formula C12H11FN2 and a molecular weight of 202.23 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole
PubChem CID158250793
Molecular FormulaC12H11FN2
Molecular Weight202.23 g/mol
Exact Mass202.09
IUPAC Name1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole
SMILESFc1ccc(-n2ncc3c2CCC3)cc1
InChIInChI=1S/C12H11FN2/c13-10-4-6-11(7-5-10)15-12-3-1-2-9(12)8-14-15/h4-8H,1-3H2
InChIKeyAZNYUESQYNDCQU-UHFFFAOYSA-N
XLogP2.50
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.23
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The IUPAC name of 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole (CID 158250793) is 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole.
What is the SMILES notation for 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The canonical SMILES for 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole is Fc1ccc(-n2ncc3c2CCC3)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole?
The InChIKey is AZNYUESQYNDCQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2/c13-10-4-6-11(7-5-10)15-12-3-1-2-9(12)8-14-15/h4-8H,1-3H2.
What are the key properties of 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole?
1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole has a molecular weight of 202.23 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazole is sourced from PubChem (CID 158250793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).