4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol

C19H14FNO2 — CID 54503099

IUPAC4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol
SMILESCOc1ccc2cc3c(O)[nH]cc3c(-c3ccc(F)cc3)c2c1
InChIInChI=1S/C19H14FNO2/c1-23-14-7-4-12-8-16-17(10-21-19(16)22)18(15(12)9-14)11-2-5-13(20)6-3-11/h2-10,21-22H,1H3
InChIKeyYDUSKFYZLVZYRX-UHFFFAOYSA-N
MW307.32 g/mol
LogP4.84
Rot. Bonds2

About 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol

4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol (PubChem CID 54503099) has the molecular formula C19H14FNO2 and a molecular weight of 307.32 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol
PubChem CID54503099
Molecular FormulaC19H14FNO2
Molecular Weight307.32 g/mol
Exact Mass307.10
IUPAC Name4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol
SMILESCOc1ccc2cc3c(O)[nH]cc3c(-c3ccc(F)cc3)c2c1
InChIInChI=1S/C19H14FNO2/c1-23-14-7-4-12-8-16-17(10-21-19(16)22)18(15(12)9-14)11-2-5-13(20)6-3-11/h2-10,21-22H,1H3
InChIKeyYDUSKFYZLVZYRX-UHFFFAOYSA-N
XLogP4.84
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.32
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(6-Methoxynaphthalen-2-yl)pyridin-3-ol
CID 25034344
4-(4-fluorophenyl)-6-methoxy-9-methyl-2H-benzo[f]isoindol-1-ol
CID 53644487
10-(4-fluorophenyl)-6-methyl-8H-[1,3]benzodioxolo[7,6-f]isoindol-7-ol
CID 53827216
10-(4-fluorophenyl)-3,8-dihydro-2H-[1]benzofuro[7,6-f]isoindol-7-ol
CID 53921366
10-(4-fluorophenyl)-6-methoxy-8H-[1,3]benzodioxolo[7,6-f]isoindol-7-ol
CID 53971709
10-(4-fluorophenyl)-8H-[1,3]benzodioxolo[7,6-f]isoindol-7-ol
CID 53991064
6-methoxy-4-[4-(trifluoromethoxy)phenyl]-2H-benzo[f]isoindol-1-ol
CID 54194048
11-(4-fluorophenyl)-3,9-dihydro-2H-[1,4]benzodioxino[8,7-f]isoindol-8-ol
CID 54208883
6-methyl-10-[4-(trifluoromethyl)phenyl]-8H-[1,3]benzodioxolo[7,6-f]isoindol-7-ol
CID 54337539
10-[4-(trifluoromethyl)phenyl]-8H-[1,3]benzodioxolo[7,6-f]isoindol-7-ol
CID 54413592
6-methoxy-4-[4-(trifluoromethyl)phenyl]-2H-benzo[f]isoindol-1-ol
CID 54479502
1-(3-Fluoro-5-(6-methoxynaphthalen-2-yl)pyridin-4-yl)ethanol
CID 69937397

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol?
The IUPAC name of 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol (CID 54503099) is 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol?
The canonical SMILES for 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol is COc1ccc2cc3c(O)[nH]cc3c(-c3ccc(F)cc3)c2c1.
What is the InChIKey of 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol?
The InChIKey is YDUSKFYZLVZYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO2/c1-23-14-7-4-12-8-16-17(10-21-19(16)22)18(15(12)9-14)11-2-5-13(20)6-3-11/h2-10,21-22H,1H3.
What are the key properties of 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol?
4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol has a molecular weight of 307.32 g/mol, XLogP of 4.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-6-methoxy-2H-benzo[f]isoindol-1-ol is sourced from PubChem (CID 54503099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).