1-(4-fluorophenyl)indole-3-carbaldehyde

C15H10FNO — CID 842655

IUPAC1-(4-fluorophenyl)indole-3-carbaldehyde
SMILESO=Cc1cn(-c2ccc(F)cc2)c2ccccc12
InChIInChI=1S/C15H10FNO/c16-12-5-7-13(8-6-12)17-9-11(10-18)14-3-1-2-4-15(14)17/h1-10H
InChIKeyRVYKBUHPOPVEPZ-UHFFFAOYSA-N
MW239.25 g/mol
LogP3.58
Rot. Bonds2

About 1-(4-fluorophenyl)indole-3-carbaldehyde

1-(4-fluorophenyl)indole-3-carbaldehyde (PubChem CID 842655) has the molecular formula C15H10FNO and a molecular weight of 239.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)indole-3-carbaldehyde.

Molecular Properties

Compound Name1-(4-fluorophenyl)indole-3-carbaldehyde
PubChem CID842655
Molecular FormulaC15H10FNO
Molecular Weight239.25 g/mol
Exact Mass239.07
IUPAC Name1-(4-fluorophenyl)indole-3-carbaldehyde
SMILESO=Cc1cn(-c2ccc(F)cc2)c2ccccc12
InChIInChI=1S/C15H10FNO/c16-12-5-7-13(8-6-12)17-9-11(10-18)14-3-1-2-4-15(14)17/h1-10H
InChIKeyRVYKBUHPOPVEPZ-UHFFFAOYSA-N
XLogP3.58
TPSA22.00 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 ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Jwh 018
CID 10382701
(1-Butyl-1H-indol-3-yl)-1-naphthalenylmethanone
CID 10471670
Indole-3-Carboxaldehyde
CID 10256
Jwh 122
CID 44466638
Xlr 11
CID 57501498
(4-Ethyl-1-naphthalenyl)(1-pentyl-1H-indol-3-yl)methanone
CID 45270396
AM 2201
CID 53393997
(1-pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
CID 44626619
AM-694
CID 9889172
1-methoxy-1H-indole-3-carbaldehyde
CID 398554
Jwh 307
CID 16049783
Jwh 203
CID 44397500

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)indole-3-carbaldehyde?
The IUPAC name of 1-(4-fluorophenyl)indole-3-carbaldehyde (CID 842655) is 1-(4-fluorophenyl)indole-3-carbaldehyde.
What is the SMILES notation for 1-(4-fluorophenyl)indole-3-carbaldehyde?
The canonical SMILES for 1-(4-fluorophenyl)indole-3-carbaldehyde is O=Cc1cn(-c2ccc(F)cc2)c2ccccc12.
What is the InChIKey of 1-(4-fluorophenyl)indole-3-carbaldehyde?
The InChIKey is RVYKBUHPOPVEPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNO/c16-12-5-7-13(8-6-12)17-9-11(10-18)14-3-1-2-4-15(14)17/h1-10H.
What are the key properties of 1-(4-fluorophenyl)indole-3-carbaldehyde?
1-(4-fluorophenyl)indole-3-carbaldehyde has a molecular weight of 239.25 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)indole-3-carbaldehyde is sourced from PubChem (CID 842655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).