2-(2-fluoroethyl)-1H-indole

C10H10FN — CID 142633825

IUPAC2-(2-fluoroethyl)-1H-indole
SMILESFCCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H10FN/c11-6-5-9-7-8-3-1-2-4-10(8)12-9/h1-4,7,12H,5-6H2
InChIKeyITMFICGGQUKWCD-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.68
Rot. Bonds2

About 2-(2-fluoroethyl)-1H-indole

2-(2-fluoroethyl)-1H-indole (PubChem CID 142633825) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 2-(2-fluoroethyl)-1H-indole.

Molecular Properties

Compound Name2-(2-fluoroethyl)-1H-indole
PubChem CID142633825
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name2-(2-fluoroethyl)-1H-indole
SMILESFCCc1cc2ccccc2[nH]1
InChIInChI=1S/C10H10FN/c11-6-5-9-7-8-3-1-2-4-10(8)12-9/h1-4,7,12H,5-6H2
InChIKeyITMFICGGQUKWCD-UHFFFAOYSA-N
XLogP2.68
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoroethyl)-1H-indole?
The IUPAC name of 2-(2-fluoroethyl)-1H-indole (CID 142633825) is 2-(2-fluoroethyl)-1H-indole.
What is the SMILES notation for 2-(2-fluoroethyl)-1H-indole?
The canonical SMILES for 2-(2-fluoroethyl)-1H-indole is FCCc1cc2ccccc2[nH]1.
What is the InChIKey of 2-(2-fluoroethyl)-1H-indole?
The InChIKey is ITMFICGGQUKWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c11-6-5-9-7-8-3-1-2-4-10(8)12-9/h1-4,7,12H,5-6H2.
What are the key properties of 2-(2-fluoroethyl)-1H-indole?
2-(2-fluoroethyl)-1H-indole has a molecular weight of 163.19 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoroethyl)-1H-indole is sourced from PubChem (CID 142633825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).