6-bromo-1-(2-fluoroethyl)indole

C10H9BrFN — CID 116622037

IUPAC6-bromo-1-(2-fluoroethyl)indole
SMILESFCCn1ccc2ccc(Br)cc21
InChIInChI=1S/C10H9BrFN/c11-9-2-1-8-3-5-13(6-4-12)10(8)7-9/h1-3,5,7H,4,6H2
InChIKeyCYUHHYLMVREDSI-UHFFFAOYSA-N
MW242.09 g/mol
LogP3.37
Rot. Bonds2

About 6-bromo-1-(2-fluoroethyl)indole

6-bromo-1-(2-fluoroethyl)indole (PubChem CID 116622037) has the molecular formula C10H9BrFN and a molecular weight of 242.09 g/mol. Its IUPAC name is 6-bromo-1-(2-fluoroethyl)indole.

Molecular Properties

Compound Name6-bromo-1-(2-fluoroethyl)indole
PubChem CID116622037
Molecular FormulaC10H9BrFN
Molecular Weight242.09 g/mol
Exact Mass240.99
IUPAC Name6-bromo-1-(2-fluoroethyl)indole
SMILESFCCn1ccc2ccc(Br)cc21
InChIInChI=1S/C10H9BrFN/c11-9-2-1-8-3-5-13(6-4-12)10(8)7-9/h1-3,5,7H,4,6H2
InChIKeyCYUHHYLMVREDSI-UHFFFAOYSA-N
XLogP3.37
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.09
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-bromo-1-(2-fluoroethyl)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-(6-bromoindol-1-yl)butan-1-amine
CID 62566051
4-(6-bromoindol-1-yl)butan-1-ol
CID 116621821
6-bromo-1-but-3-enylindole
CID 116622027
6-bromo-1-(3-methylbutyl)indole
CID 116621828
6-bromo-1-(2-methylsulfonylethyl)indole
CID 116621937
N-[3-(6-bromoindol-1-yl)propyl]aniline
CID 63506154
6-bromo-1-(3-methylsulfonylpropyl)indole
CID 116621947
6-bromo-1-(4-phenylbutyl)indole
CID 114334825
1-(2-fluoroethyl)indole
CID 80694500
3-(6-bromoindol-1-yl)-1-phenylpropan-1-one
CID 116691910
N-[3-(6-bromoindol-1-yl)propyl]cyclopropanamine
CID 62567358
6-bromo-1-[11-methyl-10,10-di(propan-2-yl)dodecyl]indole
CID 151276834

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1-(2-fluoroethyl)indole?
The IUPAC name of 6-bromo-1-(2-fluoroethyl)indole (CID 116622037) is 6-bromo-1-(2-fluoroethyl)indole.
What is the SMILES notation for 6-bromo-1-(2-fluoroethyl)indole?
The canonical SMILES for 6-bromo-1-(2-fluoroethyl)indole is FCCn1ccc2ccc(Br)cc21.
What is the InChIKey of 6-bromo-1-(2-fluoroethyl)indole?
The InChIKey is CYUHHYLMVREDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrFN/c11-9-2-1-8-3-5-13(6-4-12)10(8)7-9/h1-3,5,7H,4,6H2.
What are the key properties of 6-bromo-1-(2-fluoroethyl)indole?
6-bromo-1-(2-fluoroethyl)indole has a molecular weight of 242.09 g/mol, XLogP of 3.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1-(2-fluoroethyl)indole is sourced from PubChem (CID 116622037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).