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

C15H12FNO — CID 165356764

IUPAC2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol
SMILESCc1c(-c2ccc(O)c(F)c2)[nH]c2ccccc12
InChIInChI=1S/C15H12FNO/c1-9-11-4-2-3-5-13(11)17-15(9)10-6-7-14(18)12(16)8-10/h2-8,17-18H,1H3
InChIKeyGEVWBTLVWUETPQ-UHFFFAOYSA-N
MW241.27 g/mol
LogP3.99
Rot. Bonds1

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

2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol (PubChem CID 165356764) has the molecular formula C15H12FNO and a molecular weight of 241.27 g/mol. Its IUPAC name is 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol.

Molecular Properties

Compound Name2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol
PubChem CID165356764
Molecular FormulaC15H12FNO
Molecular Weight241.27 g/mol
Exact Mass241.09
IUPAC Name2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol
SMILESCc1c(-c2ccc(O)c(F)c2)[nH]c2ccccc12
InChIInChI=1S/C15H12FNO/c1-9-11-4-2-3-5-13(11)17-15(9)10-6-7-14(18)12(16)8-10/h2-8,17-18H,1H3
InChIKeyGEVWBTLVWUETPQ-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-(3-methyl-1H-indol-2-yl)phenol?
The IUPAC name of 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol (CID 165356764) is 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol.
What is the SMILES notation for 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol?
The canonical SMILES for 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol is Cc1c(-c2ccc(O)c(F)c2)[nH]c2ccccc12.
What is the InChIKey of 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol?
The InChIKey is GEVWBTLVWUETPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO/c1-9-11-4-2-3-5-13(11)17-15(9)10-6-7-14(18)12(16)8-10/h2-8,17-18H,1H3.
What are the key properties of 2-fluoro-4-(3-methyl-1H-indol-2-yl)phenol?
2-fluoro-4-(3-methyl-1H-indol-2-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-(3-methyl-1H-indol-2-yl)phenol is sourced from PubChem (CID 165356764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).