5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene

C27H28 — CID 87703779

IUPAC5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
SMILESCCCC1=Cc2c(ccc(-c3ccccc3)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C27H28/c1-4-10-20-17-22-15-16-24(21-11-6-5-7-12-21)27(26(22)18-20)25-14-9-8-13-23(25)19(2)3/h5-9,11-16,18-19H,4,10,17H2,1-3H3
InChIKeyUGPKFVDNRKYKTE-UHFFFAOYSA-N
MW352.52 g/mol
LogP7.88
Rot. Bonds5

About 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene

5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene (PubChem CID 87703779) has the molecular formula C27H28 and a molecular weight of 352.52 g/mol. Its IUPAC name is 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene.

Molecular Properties

Compound Name5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
PubChem CID87703779
Molecular FormulaC27H28
Molecular Weight352.52 g/mol
Exact Mass352.22
IUPAC Name5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
SMILESCCCC1=Cc2c(ccc(-c3ccccc3)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C27H28/c1-4-10-20-17-22-15-16-24(21-11-6-5-7-12-21)27(26(22)18-20)25-14-9-8-13-23(25)19(2)3/h5-9,11-16,18-19H,4,10,17H2,1-3H3
InChIKeyUGPKFVDNRKYKTE-UHFFFAOYSA-N
XLogP7.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.52
LogP ≤ 57.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
CID 87702540
2,5-diphenyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703147
2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703016
2-phenyl-4-(2-propan-2-ylphenyl)-5-propyl-1H-indene
CID 87702838
5-tert-butyl-4-(2-phenylphenyl)-2-propyl-1H-indene
CID 87702713
5-ethyl-4-phenyl-2-propyl-1H-indene
CID 87703151
4-phenyl-6-propan-2-yl-2-propyl-1H-indene
CID 158001235
5-phenyl-4-(2-phenylphenyl)-2-propan-2-yl-1H-indene
CID 87703693
2-(2-methylpropyl)-4-phenyl-5-propyl-1H-indene
CID 87703739
2-butyl-4-(2-phenylphenyl)-1H-indene
CID 154024612
2-butan-2-yl-5-ethyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703689
[3-(2-ethyl-5-phenyl-1H-inden-4-yl)-5-trimethylsilylphenyl]-trimethylsilane
CID 87703818

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The IUPAC name of 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene (CID 87703779) is 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene.
What is the SMILES notation for 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The canonical SMILES for 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene is CCCC1=Cc2c(ccc(-c3ccccc3)c2-c2ccccc2C(C)C)C1.
What is the InChIKey of 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The InChIKey is UGPKFVDNRKYKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28/c1-4-10-20-17-22-15-16-24(21-11-6-5-7-12-21)27(26(22)18-20)25-14-9-8-13-23(25)19(2)3/h5-9,11-16,18-19H,4,10,17H2,1-3H3.
What are the key properties of 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene has a molecular weight of 352.52 g/mol, XLogP of 7.88, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene is sourced from PubChem (CID 87703779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).