5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole

C10H10FN — CID 11147900

IUPAC5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole
SMILESFc1ccc(C2=NCCC2)cc1
InChIInChI=1S/C10H10FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6H,1-2,7H2
InChIKeyRWAFNYAXDUXSKI-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.41
Rot. Bonds1

About 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole

5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole (PubChem CID 11147900) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole.

Molecular Properties

Compound Name5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole
PubChem CID11147900
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole
SMILESFc1ccc(C2=NCCC2)cc1
InChIInChI=1S/C10H10FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6H,1-2,7H2
InChIKeyRWAFNYAXDUXSKI-UHFFFAOYSA-N
XLogP2.41
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole?
The IUPAC name of 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole (CID 11147900) is 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole.
What is the SMILES notation for 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole?
The canonical SMILES for 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole is Fc1ccc(C2=NCCC2)cc1.
What is the InChIKey of 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole?
The InChIKey is RWAFNYAXDUXSKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h3-6H,1-2,7H2.
What are the key properties of 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole?
5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole has a molecular weight of 163.19 g/mol, XLogP of 2.41, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-3,4-dihydro-2H-pyrrole is sourced from PubChem (CID 11147900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).