4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol

C17H14FNO — CID 19689621

IUPAC4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol
SMILESCn1c(/C=C/c2cc(F)ccc2O)cc2ccccc21
InChIInChI=1S/C17H14FNO/c1-19-15(11-12-4-2-3-5-16(12)19)8-6-13-10-14(18)7-9-17(13)20/h2-11,20H,1H3/b8-6+
InChIKeyIKODOPKUEMURFS-SOFGYWHQSA-N
MW267.30 g/mol
LogP4.19
Rot. Bonds2

About 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol

4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol (PubChem CID 19689621) has the molecular formula C17H14FNO and a molecular weight of 267.30 g/mol. Its IUPAC name is 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol.

Molecular Properties

Compound Name4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol
PubChem CID19689621
Molecular FormulaC17H14FNO
Molecular Weight267.30 g/mol
Exact Mass267.11
IUPAC Name4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol
SMILESCn1c(/C=C/c2cc(F)ccc2O)cc2ccccc21
InChIInChI=1S/C17H14FNO/c1-19-15(11-12-4-2-3-5-16(12)19)8-6-13-10-14(18)7-9-17(13)20/h2-11,20H,1H3/b8-6+
InChIKeyIKODOPKUEMURFS-SOFGYWHQSA-N
XLogP4.19
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol 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 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol?
The IUPAC name of 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol (CID 19689621) is 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol.
What is the SMILES notation for 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol?
The canonical SMILES for 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol is Cn1c(/C=C/c2cc(F)ccc2O)cc2ccccc21.
What is the InChIKey of 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol?
The InChIKey is IKODOPKUEMURFS-SOFGYWHQSA-N. The full InChI is InChI=1S/C17H14FNO/c1-19-15(11-12-4-2-3-5-16(12)19)8-6-13-10-14(18)7-9-17(13)20/h2-11,20H,1H3/b8-6+.
What are the key properties of 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol?
4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol has a molecular weight of 267.30 g/mol, XLogP of 4.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(E)-2-(1-methylindol-2-yl)ethenyl]phenol is sourced from PubChem (CID 19689621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).