2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol

C15H12FNO — CID 56714363

IUPAC2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol
SMILESCc1cccc2c(-c3ccc(O)c(F)c3)c[nH]c12
InChIInChI=1S/C15H12FNO/c1-9-3-2-4-11-12(8-17-15(9)11)10-5-6-14(18)13(16)7-10/h2-8,17-18H,1H3
InChIKeyLCRRPGZZGUNOEJ-UHFFFAOYSA-N
MW241.27 g/mol
LogP3.99
Rot. Bonds1

About 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol

2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol (PubChem CID 56714363) has the molecular formula C15H12FNO and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol.

Molecular Properties

Compound Name2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol
PubChem CID56714363
Molecular FormulaC15H12FNO
Molecular Weight241.27 g/mol
Exact Mass241.09
IUPAC Name2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol
SMILESCc1cccc2c(-c3ccc(O)c(F)c3)c[nH]c12
InChIInChI=1S/C15H12FNO/c1-9-3-2-4-11-12(8-17-15(9)11)10-5-6-14(18)13(16)7-10/h2-8,17-18H,1H3
InChIKeyLCRRPGZZGUNOEJ-UHFFFAOYSA-N
XLogP3.99
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol?
The IUPAC name of 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol (CID 56714363) is 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol.
What is the SMILES notation for 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol?
The canonical SMILES for 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol is Cc1cccc2c(-c3ccc(O)c(F)c3)c[nH]c12.
What is the InChIKey of 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol?
The InChIKey is LCRRPGZZGUNOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO/c1-9-3-2-4-11-12(8-17-15(9)11)10-5-6-14(18)13(16)7-10/h2-8,17-18H,1H3.
What are the key properties of 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol?
2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol has a molecular weight of 241.27 g/mol, XLogP of 3.99, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(7-methyl-1H-indol-3-yl)phenol is sourced from PubChem (CID 56714363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).