1-(3-fluorophenyl)pyrrole

C10H8FN — CID 4763720

IUPAC1-(3-fluorophenyl)pyrrole
SMILESFc1cccc(-n2cccc2)c1
InChIInChI=1S/C10H8FN/c11-9-4-3-5-10(8-9)12-6-1-2-7-12/h1-8H
InChIKeyMMILNBLSOHVLCJ-UHFFFAOYSA-N
MW161.18 g/mol
LogP2.62
Rot. Bonds1

About 1-(3-fluorophenyl)pyrrole

1-(3-fluorophenyl)pyrrole (PubChem CID 4763720) has the molecular formula C10H8FN and a molecular weight of 161.18 g/mol. Its IUPAC name is 1-(3-fluorophenyl)pyrrole.

Molecular Properties

Compound Name1-(3-fluorophenyl)pyrrole
PubChem CID4763720
Molecular FormulaC10H8FN
Molecular Weight161.18 g/mol
Exact Mass161.06
IUPAC Name1-(3-fluorophenyl)pyrrole
SMILESFc1cccc(-n2cccc2)c1
InChIInChI=1S/C10H8FN/c11-9-4-3-5-10(8-9)12-6-1-2-7-12/h1-8H
InChIKeyMMILNBLSOHVLCJ-UHFFFAOYSA-N
XLogP2.62
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.18
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(3-fluorophenyl)pyrrole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-Pyrrolidinoethyl)pyridine
CID 238317
2-(1H-pyrrol-1-yl)aniline
CID 80123
1-Butylpyridinium bromide
CID 2734238
2-Fluoropyridine
CID 9746
Butylpyridinium chloride
CID 2734171
2,5-Dimethyl-1-phenylpyrrole
CID 66518
1H-Pyrrole, 1-(phenylmethyl)-
CID 74922
Indolizine
CID 9230
1,2-Dimethylpyridinium iodide
CID 70107
4-Pyrrolidinopyridine
CID 75567
2-(1-Pyrrolyl)benzylamine
CID 707327
4-Pyrrol-1-yl-phenylamine
CID 2795457

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)pyrrole?
The IUPAC name of 1-(3-fluorophenyl)pyrrole (CID 4763720) is 1-(3-fluorophenyl)pyrrole.
What is the SMILES notation for 1-(3-fluorophenyl)pyrrole?
The canonical SMILES for 1-(3-fluorophenyl)pyrrole is Fc1cccc(-n2cccc2)c1.
What is the InChIKey of 1-(3-fluorophenyl)pyrrole?
The InChIKey is MMILNBLSOHVLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN/c11-9-4-3-5-10(8-9)12-6-1-2-7-12/h1-8H.
What are the key properties of 1-(3-fluorophenyl)pyrrole?
1-(3-fluorophenyl)pyrrole has a molecular weight of 161.18 g/mol, XLogP of 2.62, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)pyrrole is sourced from PubChem (CID 4763720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).