2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene

C25H32 — CID 87703016

IUPAC2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
SMILESCCCCC1=Cc2c(ccc(C(C)C)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C25H32/c1-6-7-10-19-15-20-13-14-22(18(4)5)25(24(20)16-19)23-12-9-8-11-21(23)17(2)3/h8-9,11-14,16-18H,6-7,10,15H2,1-5H3
InChIKeyUQLJJZANWRIAMI-UHFFFAOYSA-N
MW332.53 g/mol
LogP7.73
Rot. Bonds6

About 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene

2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene (PubChem CID 87703016) has the molecular formula C25H32 and a molecular weight of 332.53 g/mol. Its IUPAC name is 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene.

Molecular Properties

Compound Name2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
PubChem CID87703016
Molecular FormulaC25H32
Molecular Weight332.53 g/mol
Exact Mass332.25
IUPAC Name2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
SMILESCCCCC1=Cc2c(ccc(C(C)C)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C25H32/c1-6-7-10-19-15-20-13-14-22(18(4)5)25(24(20)16-19)23-12-9-8-11-21(23)17(2)3/h8-9,11-14,16-18H,6-7,10,15H2,1-5H3
InChIKeyUQLJJZANWRIAMI-UHFFFAOYSA-N
XLogP7.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.53
LogP ≤ 57.73
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
5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
CID 87703779
2-phenyl-4-(2-propan-2-ylphenyl)-5-propyl-1H-indene
CID 87702838
2-butyl-5-tert-butyl-4-(2-ethylphenyl)-1H-indene
CID 87703297
2-butyl-4-(2-phenylphenyl)-1H-indene
CID 154024612
2-butan-2-yl-5-ethyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703689
4-(2-methylphenyl)-2-(2-methylpropyl)-5-propyl-1H-indene
CID 87702877
2-tert-butyl-5-methyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87702973
2,5-diphenyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703147
2-(2-butyl-6-propan-2-yl-1H-inden-4-yl)naphthalene
CID 161273622
4-(2-ethylphenyl)-2-(2-methylpropyl)-5-propyl-1H-indene
CID 87703800
2-butyl-4-(3,5-dimethylphenyl)-5-ethyl-1H-indene
CID 87703373

Frequently Asked Questions

What is the IUPAC name of 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene?
The IUPAC name of 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene (CID 87703016) is 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene.
What is the SMILES notation for 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene?
The canonical SMILES for 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene is CCCCC1=Cc2c(ccc(C(C)C)c2-c2ccccc2C(C)C)C1.
What is the InChIKey of 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene?
The InChIKey is UQLJJZANWRIAMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32/c1-6-7-10-19-15-20-13-14-22(18(4)5)25(24(20)16-19)23-12-9-8-11-21(23)17(2)3/h8-9,11-14,16-18H,6-7,10,15H2,1-5H3.
What are the key properties of 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene?
2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene has a molecular weight of 332.53 g/mol, XLogP of 7.73, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene is sourced from PubChem (CID 87703016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).