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

C22H26 — CID 87702540

IUPAC5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
SMILESCCCC1=Cc2c(ccc(C)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C22H26/c1-5-8-17-13-18-12-11-16(4)22(21(18)14-17)20-10-7-6-9-19(20)15(2)3/h6-7,9-12,14-15H,5,8,13H2,1-4H3
InChIKeyHBZDISGPDDTWCD-UHFFFAOYSA-N
MW290.45 g/mol
LogP6.53
Rot. Bonds4

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

5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene (PubChem CID 87702540) has the molecular formula C22H26 and a molecular weight of 290.45 g/mol. Its IUPAC name is 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene.

Molecular Properties

Compound Name5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
PubChem CID87702540
Molecular FormulaC22H26
Molecular Weight290.45 g/mol
Exact Mass290.20
IUPAC Name5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
SMILESCCCC1=Cc2c(ccc(C)c2-c2ccccc2C(C)C)C1
InChIInChI=1S/C22H26/c1-5-8-17-13-18-12-11-16(4)22(21(18)14-17)20-10-7-6-9-19(20)15(2)3/h6-7,9-12,14-15H,5,8,13H2,1-4H3
InChIKeyHBZDISGPDDTWCD-UHFFFAOYSA-N
XLogP6.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.45
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
CID 87703779
2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703016
2-tert-butyl-5-methyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87702973
2-phenyl-4-(2-propan-2-ylphenyl)-5-propyl-1H-indene
CID 87702838
4-(2-methylphenyl)-2-(2-methylpropyl)-5-propyl-1H-indene
CID 87702877
5-ethyl-4-phenyl-2-propyl-1H-indene
CID 87703151
4-phenyl-6-propan-2-yl-2-propyl-1H-indene
CID 158001235
2-butan-2-yl-5-ethyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703689
5-tert-butyl-4-(2-phenylphenyl)-2-propyl-1H-indene
CID 87702713
4-(2-ethylphenyl)-2-(2-methylpropyl)-5-propyl-1H-indene
CID 87703800
2,5-diphenyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703147
2,5-diethyl-4-(2-methylphenyl)-1H-indene
CID 87702914

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The IUPAC name of 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene (CID 87702540) is 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene.
What is the SMILES notation for 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The canonical SMILES for 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene is CCCC1=Cc2c(ccc(C)c2-c2ccccc2C(C)C)C1.
What is the InChIKey of 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
The InChIKey is HBZDISGPDDTWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26/c1-5-8-17-13-18-12-11-16(4)22(21(18)14-17)20-10-7-6-9-19(20)15(2)3/h6-7,9-12,14-15H,5,8,13H2,1-4H3.
What are the key properties of 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene?
5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene has a molecular weight of 290.45 g/mol, XLogP of 6.53, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene is sourced from PubChem (CID 87702540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).