4-(4-fluorophenoxy)-1H-benzo[g]indole

C18H12FNO — CID 150424562

IUPAC4-(4-fluorophenoxy)-1H-benzo[g]indole
SMILESFc1ccc(Oc2cc3ccccc3c3[nH]ccc23)cc1
InChIInChI=1S/C18H12FNO/c19-13-5-7-14(8-6-13)21-17-11-12-3-1-2-4-15(12)18-16(17)9-10-20-18/h1-11,20H
InChIKeyHIMLSLGCRLOHCO-UHFFFAOYSA-N
MW277.30 g/mol
LogP5.25
Rot. Bonds2

About 4-(4-fluorophenoxy)-1H-benzo[g]indole

4-(4-fluorophenoxy)-1H-benzo[g]indole (PubChem CID 150424562) has the molecular formula C18H12FNO and a molecular weight of 277.30 g/mol. Its IUPAC name is 4-(4-fluorophenoxy)-1H-benzo[g]indole.

Molecular Properties

Compound Name4-(4-fluorophenoxy)-1H-benzo[g]indole
PubChem CID150424562
Molecular FormulaC18H12FNO
Molecular Weight277.30 g/mol
Exact Mass277.09
IUPAC Name4-(4-fluorophenoxy)-1H-benzo[g]indole
SMILESFc1ccc(Oc2cc3ccccc3c3[nH]ccc23)cc1
InChIInChI=1S/C18H12FNO/c19-13-5-7-14(8-6-13)21-17-11-12-3-1-2-4-15(12)18-16(17)9-10-20-18/h1-11,20H
InChIKeyHIMLSLGCRLOHCO-UHFFFAOYSA-N
XLogP5.25
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500277.30
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenoxy)-1H-benzo[g]indole?
The IUPAC name of 4-(4-fluorophenoxy)-1H-benzo[g]indole (CID 150424562) is 4-(4-fluorophenoxy)-1H-benzo[g]indole.
What is the SMILES notation for 4-(4-fluorophenoxy)-1H-benzo[g]indole?
The canonical SMILES for 4-(4-fluorophenoxy)-1H-benzo[g]indole is Fc1ccc(Oc2cc3ccccc3c3[nH]ccc23)cc1.
What is the InChIKey of 4-(4-fluorophenoxy)-1H-benzo[g]indole?
The InChIKey is HIMLSLGCRLOHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FNO/c19-13-5-7-14(8-6-13)21-17-11-12-3-1-2-4-15(12)18-16(17)9-10-20-18/h1-11,20H.
What are the key properties of 4-(4-fluorophenoxy)-1H-benzo[g]indole?
4-(4-fluorophenoxy)-1H-benzo[g]indole has a molecular weight of 277.30 g/mol, XLogP of 5.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenoxy)-1H-benzo[g]indole is sourced from PubChem (CID 150424562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).