2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol

C21H16FNO2 — CID 71725343

IUPAC2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol
SMILESCOc1cccc(-n2c(-c3ccc(F)cc3)cc3c(O)cccc32)c1
InChIInChI=1S/C21H16FNO2/c1-25-17-5-2-4-16(12-17)23-19-6-3-7-21(24)18(19)13-20(23)14-8-10-15(22)11-9-14/h2-13,24H,1H3
InChIKeyYGLXUMKWKYGEJK-UHFFFAOYSA-N
MW333.36 g/mol
LogP5.15
Rot. Bonds3

About 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol

2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol (PubChem CID 71725343) has the molecular formula C21H16FNO2 and a molecular weight of 333.36 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol
PubChem CID71725343
Molecular FormulaC21H16FNO2
Molecular Weight333.36 g/mol
Exact Mass333.12
IUPAC Name2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol
SMILESCOc1cccc(-n2c(-c3ccc(F)cc3)cc3c(O)cccc32)c1
InChIInChI=1S/C21H16FNO2/c1-25-17-5-2-4-16(12-17)23-19-6-3-7-21(24)18(19)13-20(23)14-8-10-15(22)11-9-14/h2-13,24H,1H3
InChIKeyYGLXUMKWKYGEJK-UHFFFAOYSA-N
XLogP5.15
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.36
LogP ≤ 55.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chlorophenyl)-2-(4-methoxyphenyl)indol-4-ol
CID 71725275
5-[(4-fluorophenyl)methyl]-6-hydroxy-1-(3-methoxyphenyl)pyrimidine-2,4-dione
CID 4907666
3-(4-fluorophenyl)sulfanyl-4-hydroxy-6-(3-methoxyphenyl)-7-phenylpyrano[3,2-c]pyridine-2,5-dione
CID 59241370
2-[[(Z)-1-[5-(4-fluorophenyl)-1-(3-methoxyphenyl)-2-methylpyrrol-3-yl]ethylideneamino]oxymethyl]benzonitrile
CID 42796622
7-(4-fluorophenyl)-6-(3-methoxyphenyl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
CID 4527780
[4-[3-(3-methoxycarbazol-9-yl)phenyl]phenyl]phosphonic acid
CID 177244626
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol
CID 157369314
3-[10-(4-fluorophenyl)anthracen-9-yl]-9-phenylcarbazole
CID 170395491
3-[2-[4-(trifluoromethoxy)phenyl]benzo[e]indol-3-yl]benzoic acid
CID 59214608
1-[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl-4-(3-methoxyphenyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one
CID 16506840
9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole
CID 23534185
3-(4-fluorophenyl)-5-(3-methoxyphenyl)-1-methylpyrazole
CID 22104457

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol?
The IUPAC name of 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol (CID 71725343) is 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol.
What is the SMILES notation for 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol?
The canonical SMILES for 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol is COc1cccc(-n2c(-c3ccc(F)cc3)cc3c(O)cccc32)c1.
What is the InChIKey of 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol?
The InChIKey is YGLXUMKWKYGEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FNO2/c1-25-17-5-2-4-16(12-17)23-19-6-3-7-21(24)18(19)13-20(23)14-8-10-15(22)11-9-14/h2-13,24H,1H3.
What are the key properties of 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol?
2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol has a molecular weight of 333.36 g/mol, XLogP of 5.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-1-(3-methoxyphenyl)indol-4-ol is sourced from PubChem (CID 71725343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).