4-(4-fluorophenyl)-1H-pyrrol-2-ol

C10H8FNO — CID 90777003

IUPAC4-(4-fluorophenyl)-1H-pyrrol-2-ol
SMILESOc1cc(-c2ccc(F)cc2)c[nH]1
InChIInChI=1S/C10H8FNO/c11-9-3-1-7(2-4-9)8-5-10(13)12-6-8/h1-6,12-13H
InChIKeyCETGDGRAVGPQID-UHFFFAOYSA-N
MW177.18 g/mol
LogP2.53
Rot. Bonds1

About 4-(4-fluorophenyl)-1H-pyrrol-2-ol

4-(4-fluorophenyl)-1H-pyrrol-2-ol (PubChem CID 90777003) has the molecular formula C10H8FNO and a molecular weight of 177.18 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1H-pyrrol-2-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1H-pyrrol-2-ol
PubChem CID90777003
Molecular FormulaC10H8FNO
Molecular Weight177.18 g/mol
Exact Mass177.06
IUPAC Name4-(4-fluorophenyl)-1H-pyrrol-2-ol
SMILESOc1cc(-c2ccc(F)cc2)c[nH]1
InChIInChI=1S/C10H8FNO/c11-9-3-1-7(2-4-9)8-5-10(13)12-6-8/h1-6,12-13H
InChIKeyCETGDGRAVGPQID-UHFFFAOYSA-N
XLogP2.53
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.18
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1H-pyrrol-2-ol?
The IUPAC name of 4-(4-fluorophenyl)-1H-pyrrol-2-ol (CID 90777003) is 4-(4-fluorophenyl)-1H-pyrrol-2-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-1H-pyrrol-2-ol?
The canonical SMILES for 4-(4-fluorophenyl)-1H-pyrrol-2-ol is Oc1cc(-c2ccc(F)cc2)c[nH]1.
What is the InChIKey of 4-(4-fluorophenyl)-1H-pyrrol-2-ol?
The InChIKey is CETGDGRAVGPQID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO/c11-9-3-1-7(2-4-9)8-5-10(13)12-6-8/h1-6,12-13H.
What are the key properties of 4-(4-fluorophenyl)-1H-pyrrol-2-ol?
4-(4-fluorophenyl)-1H-pyrrol-2-ol has a molecular weight of 177.18 g/mol, XLogP of 2.53, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1H-pyrrol-2-ol is sourced from PubChem (CID 90777003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).