2-fluoro-4-methoxy-1H-indole

C9H8FNO — CID 174907936

IUPAC2-fluoro-4-methoxy-1H-indole
SMILESCOc1cccc2[nH]c(F)cc12
InChIInChI=1S/C9H8FNO/c1-12-8-4-2-3-7-6(8)5-9(10)11-7/h2-5,11H,1H3
InChIKeyLYVJEOSZWHZVCV-UHFFFAOYSA-N
MW165.17 g/mol
LogP2.32
Rot. Bonds1

About 2-fluoro-4-methoxy-1H-indole

2-fluoro-4-methoxy-1H-indole (PubChem CID 174907936) has the molecular formula C9H8FNO and a molecular weight of 165.17 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-1H-indole.

Molecular Properties

Compound Name2-fluoro-4-methoxy-1H-indole
PubChem CID174907936
Molecular FormulaC9H8FNO
Molecular Weight165.17 g/mol
Exact Mass165.06
IUPAC Name2-fluoro-4-methoxy-1H-indole
SMILESCOc1cccc2[nH]c(F)cc12
InChIInChI=1S/C9H8FNO/c1-12-8-4-2-3-7-6(8)5-9(10)11-7/h2-5,11H,1H3
InChIKeyLYVJEOSZWHZVCV-UHFFFAOYSA-N
XLogP2.32
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.17
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-4-methoxy-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxy-1H-indole-2-carbonyl chloride
CID 53404354
4-methoxy-2-methyl-1H-indole;2-methyl-1H-indole
CID 159600634
4-methoxy-2-(4-methoxyphenyl)-1H-indole
CID 159214029
N-hydroperoxy-4-methoxy-1H-indol-2-amine
CID 142093209
1-(4-methoxy-1H-indol-2-yl)-2-methylpropan-2-ol
CID 117194596
2-(4-methoxy-1H-indol-2-yl)acetic acid
CID 28806414
1H-indol-2-yl-(4-methoxy-1H-indol-2-yl)methanone
CID 11543838
ethyl 2-(4-methoxy-1H-indol-2-yl)-2-oxoacetate
CID 115072498
1,2,3-trimethoxybenzene;hydrofluoride
CID 174818666
3-(4-methoxy-1H-indol-2-yl)-1,2-oxazole-5-carboxylic acid
CID 136985700
N-[2-(4-methoxy-1H-indol-2-yl)ethyl]acetamide
CID 10513751
1-methoxy-5,7-dihydroindolo[2,3-b]carbazole
CID 141287625

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-1H-indole?
The IUPAC name of 2-fluoro-4-methoxy-1H-indole (CID 174907936) is 2-fluoro-4-methoxy-1H-indole.
What is the SMILES notation for 2-fluoro-4-methoxy-1H-indole?
The canonical SMILES for 2-fluoro-4-methoxy-1H-indole is COc1cccc2[nH]c(F)cc12.
What is the InChIKey of 2-fluoro-4-methoxy-1H-indole?
The InChIKey is LYVJEOSZWHZVCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNO/c1-12-8-4-2-3-7-6(8)5-9(10)11-7/h2-5,11H,1H3.
What are the key properties of 2-fluoro-4-methoxy-1H-indole?
2-fluoro-4-methoxy-1H-indole has a molecular weight of 165.17 g/mol, XLogP of 2.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-1H-indole is sourced from PubChem (CID 174907936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).