2-(2-fluorophenyl)-3H-indole-3-carbaldehyde

C15H10FNO — CID 174973417

IUPAC2-(2-fluorophenyl)-3H-indole-3-carbaldehyde
SMILESO=CC1C(c2ccccc2F)=Nc2ccccc21
InChIInChI=1S/C15H10FNO/c16-13-7-3-1-6-11(13)15-12(9-18)10-5-2-4-8-14(10)17-15/h1-9,12H
InChIKeyFVBIBFXMCAVFMW-UHFFFAOYSA-N
MW239.25 g/mol
LogP3.24
Rot. Bonds2

About 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde

2-(2-fluorophenyl)-3H-indole-3-carbaldehyde (PubChem CID 174973417) has the molecular formula C15H10FNO and a molecular weight of 239.25 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde.

Molecular Properties

Compound Name2-(2-fluorophenyl)-3H-indole-3-carbaldehyde
PubChem CID174973417
Molecular FormulaC15H10FNO
Molecular Weight239.25 g/mol
Exact Mass239.07
IUPAC Name2-(2-fluorophenyl)-3H-indole-3-carbaldehyde
SMILESO=CC1C(c2ccccc2F)=Nc2ccccc21
InChIInChI=1S/C15H10FNO/c16-13-7-3-1-6-11(13)15-12(9-18)10-5-2-4-8-14(10)17-15/h1-9,12H
InChIKeyFVBIBFXMCAVFMW-UHFFFAOYSA-N
XLogP3.24
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.25
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde?
The IUPAC name of 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde (CID 174973417) is 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde.
What is the SMILES notation for 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde?
The canonical SMILES for 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde is O=CC1C(c2ccccc2F)=Nc2ccccc21.
What is the InChIKey of 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde?
The InChIKey is FVBIBFXMCAVFMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNO/c16-13-7-3-1-6-11(13)15-12(9-18)10-5-2-4-8-14(10)17-15/h1-9,12H.
What are the key properties of 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde?
2-(2-fluorophenyl)-3H-indole-3-carbaldehyde has a molecular weight of 239.25 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-3H-indole-3-carbaldehyde is sourced from PubChem (CID 174973417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).