1-ethyl-2,3-dihydro-1H-indene

C11H14 — CID 20971

IUPAC1-ethyl-2,3-dihydro-1H-indene
SMILESCCC1CCc2ccccc21
InChIInChI=1S/C11H14/c1-2-9-7-8-10-5-3-4-6-11(9)10/h3-6,9H,2,7-8H2,1H3
InChIKeySECAQUZEXAHWBA-UHFFFAOYSA-N
MW146.23 g/mol
LogP3.13
Rot. Bonds1

About 1-ethyl-2,3-dihydro-1H-indene

1-ethyl-2,3-dihydro-1H-indene (PubChem CID 20971) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is 1-ethyl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-ethyl-2,3-dihydro-1H-indene
PubChem CID20971
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name1-ethyl-2,3-dihydro-1H-indene
SMILESCCC1CCc2ccccc21
InChIInChI=1S/C11H14/c1-2-9-7-8-10-5-3-4-6-11(9)10/h3-6,9H,2,7-8H2,1H3
InChIKeySECAQUZEXAHWBA-UHFFFAOYSA-N
XLogP3.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,3-dihydro-1H-indene?
The IUPAC name of 1-ethyl-2,3-dihydro-1H-indene (CID 20971) is 1-ethyl-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-ethyl-2,3-dihydro-1H-indene?
The canonical SMILES for 1-ethyl-2,3-dihydro-1H-indene is CCC1CCc2ccccc21.
What is the InChIKey of 1-ethyl-2,3-dihydro-1H-indene?
The InChIKey is SECAQUZEXAHWBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14/c1-2-9-7-8-10-5-3-4-6-11(9)10/h3-6,9H,2,7-8H2,1H3.
What are the key properties of 1-ethyl-2,3-dihydro-1H-indene?
1-ethyl-2,3-dihydro-1H-indene has a molecular weight of 146.23 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2,3-dihydro-1H-indene is sourced from PubChem (CID 20971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).