7-ethyl-4-propyl-1H-indene

C14H18 — CID 57296911

IUPAC7-ethyl-4-propyl-1H-indene
SMILESCCCc1ccc(CC)c2c1C=CC2
InChIInChI=1S/C14H18/c1-3-6-12-10-9-11(4-2)13-7-5-8-14(12)13/h5,8-10H,3-4,6-7H2,1-2H3
InChIKeyFOOIZNIYJFBQBK-UHFFFAOYSA-N
MW186.30 g/mol
LogP3.77
Rot. Bonds3

About 7-ethyl-4-propyl-1H-indene

7-ethyl-4-propyl-1H-indene (PubChem CID 57296911) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is 7-ethyl-4-propyl-1H-indene.

Molecular Properties

Compound Name7-ethyl-4-propyl-1H-indene
PubChem CID57296911
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Name7-ethyl-4-propyl-1H-indene
SMILESCCCc1ccc(CC)c2c1C=CC2
InChIInChI=1S/C14H18/c1-3-6-12-10-9-11(4-2)13-7-5-8-14(12)13/h5,8-10H,3-4,6-7H2,1-2H3
InChIKeyFOOIZNIYJFBQBK-UHFFFAOYSA-N
XLogP3.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-propyl-1H-indene?
The IUPAC name of 7-ethyl-4-propyl-1H-indene (CID 57296911) is 7-ethyl-4-propyl-1H-indene.
What is the SMILES notation for 7-ethyl-4-propyl-1H-indene?
The canonical SMILES for 7-ethyl-4-propyl-1H-indene is CCCc1ccc(CC)c2c1C=CC2.
What is the InChIKey of 7-ethyl-4-propyl-1H-indene?
The InChIKey is FOOIZNIYJFBQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-3-6-12-10-9-11(4-2)13-7-5-8-14(12)13/h5,8-10H,3-4,6-7H2,1-2H3.
What are the key properties of 7-ethyl-4-propyl-1H-indene?
7-ethyl-4-propyl-1H-indene has a molecular weight of 186.30 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-propyl-1H-indene is sourced from PubChem (CID 57296911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).