1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene

C22H20 — CID 139709796

IUPAC1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene
SMILESCC(c1ccccc1)(C1C=CC=C1)C1C=Cc2ccccc21
InChIInChI=1S/C22H20/c1-22(19-12-6-7-13-19,18-10-3-2-4-11-18)21-16-15-17-9-5-8-14-20(17)21/h2-16,19,21H,1H3
InChIKeyUUDNISZHTPQKKT-UHFFFAOYSA-N
MW284.40 g/mol
LogP5.50
Rot. Bonds3

About 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene

1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene (PubChem CID 139709796) has the molecular formula C22H20 and a molecular weight of 284.40 g/mol. Its IUPAC name is 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene.

Molecular Properties

Compound Name1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene
PubChem CID139709796
Molecular FormulaC22H20
Molecular Weight284.40 g/mol
Exact Mass284.16
IUPAC Name1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene
SMILESCC(c1ccccc1)(C1C=CC=C1)C1C=Cc2ccccc21
InChIInChI=1S/C22H20/c1-22(19-12-6-7-13-19,18-10-3-2-4-11-18)21-16-15-17-9-5-8-14-20(17)21/h2-16,19,21H,1H3
InChIKeyUUDNISZHTPQKKT-UHFFFAOYSA-N
XLogP5.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.40
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene?
The IUPAC name of 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene (CID 139709796) is 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene.
What is the SMILES notation for 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene?
The canonical SMILES for 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene is CC(c1ccccc1)(C1C=CC=C1)C1C=Cc2ccccc21.
What is the InChIKey of 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene?
The InChIKey is UUDNISZHTPQKKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20/c1-22(19-12-6-7-13-19,18-10-3-2-4-11-18)21-16-15-17-9-5-8-14-20(17)21/h2-16,19,21H,1H3.
What are the key properties of 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene?
1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene has a molecular weight of 284.40 g/mol, XLogP of 5.50, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopenta-2,4-dien-1-yl-1-phenylethyl)-1H-indene is sourced from PubChem (CID 139709796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).