3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole

C14H12FNOS — CID 138983777

IUPAC3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole
SMILESCOc1ccc2c(c1)c(F)c(-c1cccs1)n2C
InChIInChI=1S/C14H12FNOS/c1-16-11-6-5-9(17-2)8-10(11)13(15)14(16)12-4-3-7-18-12/h3-8H,1-2H3
InChIKeyWABSBNRTSXTTLZ-UHFFFAOYSA-N
MW261.32 g/mol
LogP4.05
Rot. Bonds2

About 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole

3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole (PubChem CID 138983777) has the molecular formula C14H12FNOS and a molecular weight of 261.32 g/mol. Its IUPAC name is 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole.

Molecular Properties

Compound Name3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole
PubChem CID138983777
Molecular FormulaC14H12FNOS
Molecular Weight261.32 g/mol
Exact Mass261.06
IUPAC Name3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole
SMILESCOc1ccc2c(c1)c(F)c(-c1cccs1)n2C
InChIInChI=1S/C14H12FNOS/c1-16-11-6-5-9(17-2)8-10(11)13(15)14(16)12-4-3-7-18-12/h3-8H,1-2H3
InChIKeyWABSBNRTSXTTLZ-UHFFFAOYSA-N
XLogP4.05
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole 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-(5-Methoxy-1,2-dimethylindol-3-yl)-1,3-thiazol-2-amine
CID 804956
6-Methoxy-3-thiophen-3-yl-quinoline
CID 10083051
3-methoxy-9-methyl-9H-carbazole
CID 2059429
BW-723C86
CID 5311036
1-(5-(2-Thenyloxy)-1H-indol-3-yl)propan-2-amine
CID 4284720
{2-[5-Methoxy-1-(thiophene-2-sulfonyl)-1H-indol-3-yl]-ethyl}-dimethyl-amine
CID 9885426
10-methyl-5,10-dihydro-4H-thieno[3,2-a]carbazol-7-ol
CID 44412044
3-[2-(5-Methoxy-2-methyl-1H-indol-3-YL)ethyl]-1-phenyl-3-[(thiophen-2-YL)methyl]thiourea
CID 2158147
1-(3-Fluorophenyl)-3-[2-(5-methoxy-2-methyl-1H-indol-3-YL)ethyl]-3-[(thiophen-2-YL)methyl]thiourea
CID 2158155
1-(4-Fluorophenyl)-3-[2-(5-methoxy-2-methyl-1H-indol-3-YL)ethyl]-3-[(thiophen-2-YL)methyl]thiourea
CID 2158156
Lopac-B-175
CID 6603733
2-(4-Methoxyphenyl)-1-methyl-3-(2-thiophen-3-ylethynyl)indole
CID 24818819

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole?
The IUPAC name of 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole (CID 138983777) is 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole.
What is the SMILES notation for 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole?
The canonical SMILES for 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole is COc1ccc2c(c1)c(F)c(-c1cccs1)n2C.
What is the InChIKey of 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole?
The InChIKey is WABSBNRTSXTTLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNOS/c1-16-11-6-5-9(17-2)8-10(11)13(15)14(16)12-4-3-7-18-12/h3-8H,1-2H3.
What are the key properties of 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole?
3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole has a molecular weight of 261.32 g/mol, XLogP of 4.05, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-5-methoxy-1-methyl-2-thiophen-2-ylindole is sourced from PubChem (CID 138983777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).