1-(2-fluoro-4-methylphenyl)pyrrole

C11H10FN — CID 19759552

IUPAC1-(2-fluoro-4-methylphenyl)pyrrole
SMILESCc1ccc(-n2cccc2)c(F)c1
InChIInChI=1S/C11H10FN/c1-9-4-5-11(10(12)8-9)13-6-2-3-7-13/h2-8H,1H3
InChIKeyILDZCBIBWILXNM-UHFFFAOYSA-N
MW175.21 g/mol
LogP2.92
Rot. Bonds1

About 1-(2-fluoro-4-methylphenyl)pyrrole

1-(2-fluoro-4-methylphenyl)pyrrole (PubChem CID 19759552) has the molecular formula C11H10FN and a molecular weight of 175.21 g/mol. Its IUPAC name is 1-(2-fluoro-4-methylphenyl)pyrrole.

Molecular Properties

Compound Name1-(2-fluoro-4-methylphenyl)pyrrole
PubChem CID19759552
Molecular FormulaC11H10FN
Molecular Weight175.21 g/mol
Exact Mass175.08
IUPAC Name1-(2-fluoro-4-methylphenyl)pyrrole
SMILESCc1ccc(-n2cccc2)c(F)c1
InChIInChI=1S/C11H10FN/c1-9-4-5-11(10(12)8-9)13-6-2-3-7-13/h2-8H,1H3
InChIKeyILDZCBIBWILXNM-UHFFFAOYSA-N
XLogP2.92
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(2-fluoro-4-methylphenyl)pyrrole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-4-methylphenyl)pyrrole?
The IUPAC name of 1-(2-fluoro-4-methylphenyl)pyrrole (CID 19759552) is 1-(2-fluoro-4-methylphenyl)pyrrole.
What is the SMILES notation for 1-(2-fluoro-4-methylphenyl)pyrrole?
The canonical SMILES for 1-(2-fluoro-4-methylphenyl)pyrrole is Cc1ccc(-n2cccc2)c(F)c1.
What is the InChIKey of 1-(2-fluoro-4-methylphenyl)pyrrole?
The InChIKey is ILDZCBIBWILXNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN/c1-9-4-5-11(10(12)8-9)13-6-2-3-7-13/h2-8H,1H3.
What are the key properties of 1-(2-fluoro-4-methylphenyl)pyrrole?
1-(2-fluoro-4-methylphenyl)pyrrole has a molecular weight of 175.21 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-4-methylphenyl)pyrrole is sourced from PubChem (CID 19759552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).