5-ethyl-2-methyl-2,3-dihydro-1H-indole

C11H15N — CID 70571795

IUPAC5-ethyl-2-methyl-2,3-dihydro-1H-indole
SMILESCCc1ccc2c(c1)CC(C)N2
InChIInChI=1S/C11H15N/c1-3-9-4-5-11-10(7-9)6-8(2)12-11/h4-5,7-8,12H,3,6H2,1-2H3
InChIKeyKZFPDVZRMYOTFD-UHFFFAOYSA-N
MW161.25 g/mol
LogP2.61
Rot. Bonds1

About 5-ethyl-2-methyl-2,3-dihydro-1H-indole

5-ethyl-2-methyl-2,3-dihydro-1H-indole (PubChem CID 70571795) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is 5-ethyl-2-methyl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name5-ethyl-2-methyl-2,3-dihydro-1H-indole
PubChem CID70571795
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name5-ethyl-2-methyl-2,3-dihydro-1H-indole
SMILESCCc1ccc2c(c1)CC(C)N2
InChIInChI=1S/C11H15N/c1-3-9-4-5-11-10(7-9)6-8(2)12-11/h4-5,7-8,12H,3,6H2,1-2H3
InChIKeyKZFPDVZRMYOTFD-UHFFFAOYSA-N
XLogP2.61
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-methyl-2,3-dihydro-1H-indole?
The IUPAC name of 5-ethyl-2-methyl-2,3-dihydro-1H-indole (CID 70571795) is 5-ethyl-2-methyl-2,3-dihydro-1H-indole.
What is the SMILES notation for 5-ethyl-2-methyl-2,3-dihydro-1H-indole?
The canonical SMILES for 5-ethyl-2-methyl-2,3-dihydro-1H-indole is CCc1ccc2c(c1)CC(C)N2.
What is the InChIKey of 5-ethyl-2-methyl-2,3-dihydro-1H-indole?
The InChIKey is KZFPDVZRMYOTFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N/c1-3-9-4-5-11-10(7-9)6-8(2)12-11/h4-5,7-8,12H,3,6H2,1-2H3.
What are the key properties of 5-ethyl-2-methyl-2,3-dihydro-1H-indole?
5-ethyl-2-methyl-2,3-dihydro-1H-indole has a molecular weight of 161.25 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methyl-2,3-dihydro-1H-indole is sourced from PubChem (CID 70571795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).