2-benzyl-1-ethyl-2,3-dihydroindole

C17H19N — CID 70645248

IUPAC2-benzyl-1-ethyl-2,3-dihydroindole
SMILESCCN1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C17H19N/c1-2-18-16(12-14-8-4-3-5-9-14)13-15-10-6-7-11-17(15)18/h3-11,16H,2,12-13H2,1H3
InChIKeyFJTOSGUJSFZMHN-UHFFFAOYSA-N
MW237.35 g/mol
LogP3.68
Rot. Bonds3

About 2-benzyl-1-ethyl-2,3-dihydroindole

2-benzyl-1-ethyl-2,3-dihydroindole (PubChem CID 70645248) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-benzyl-1-ethyl-2,3-dihydroindole.

Molecular Properties

Compound Name2-benzyl-1-ethyl-2,3-dihydroindole
PubChem CID70645248
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name2-benzyl-1-ethyl-2,3-dihydroindole
SMILESCCN1c2ccccc2CC1Cc1ccccc1
InChIInChI=1S/C17H19N/c1-2-18-16(12-14-8-4-3-5-9-14)13-15-10-6-7-11-17(15)18/h3-11,16H,2,12-13H2,1H3
InChIKeyFJTOSGUJSFZMHN-UHFFFAOYSA-N
XLogP3.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1-ethyl-2,3-dihydroindole?
The IUPAC name of 2-benzyl-1-ethyl-2,3-dihydroindole (CID 70645248) is 2-benzyl-1-ethyl-2,3-dihydroindole.
What is the SMILES notation for 2-benzyl-1-ethyl-2,3-dihydroindole?
The canonical SMILES for 2-benzyl-1-ethyl-2,3-dihydroindole is CCN1c2ccccc2CC1Cc1ccccc1.
What is the InChIKey of 2-benzyl-1-ethyl-2,3-dihydroindole?
The InChIKey is FJTOSGUJSFZMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-2-18-16(12-14-8-4-3-5-9-14)13-15-10-6-7-11-17(15)18/h3-11,16H,2,12-13H2,1H3.
What are the key properties of 2-benzyl-1-ethyl-2,3-dihydroindole?
2-benzyl-1-ethyl-2,3-dihydroindole has a molecular weight of 237.35 g/mol, XLogP of 3.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1-ethyl-2,3-dihydroindole is sourced from PubChem (CID 70645248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).