4-phenyl-6-propan-2-yl-2-propyl-1H-indene

C21H24 — CID 158001235

IUPAC4-phenyl-6-propan-2-yl-2-propyl-1H-indene
SMILESCCCC1=Cc2c(cc(C(C)C)cc2-c2ccccc2)C1
InChIInChI=1S/C21H24/c1-4-8-16-11-19-13-18(15(2)3)14-21(20(19)12-16)17-9-6-5-7-10-17/h5-7,9-10,12-15H,4,8,11H2,1-3H3
InChIKeyBQPZBCQVHBYVPB-UHFFFAOYSA-N
MW276.42 g/mol
LogP6.22
Rot. Bonds4

About 4-phenyl-6-propan-2-yl-2-propyl-1H-indene

4-phenyl-6-propan-2-yl-2-propyl-1H-indene (PubChem CID 158001235) has the molecular formula C21H24 and a molecular weight of 276.42 g/mol. Its IUPAC name is 4-phenyl-6-propan-2-yl-2-propyl-1H-indene.

Molecular Properties

Compound Name4-phenyl-6-propan-2-yl-2-propyl-1H-indene
PubChem CID158001235
Molecular FormulaC21H24
Molecular Weight276.42 g/mol
Exact Mass276.19
IUPAC Name4-phenyl-6-propan-2-yl-2-propyl-1H-indene
SMILESCCCC1=Cc2c(cc(C(C)C)cc2-c2ccccc2)C1
InChIInChI=1S/C21H24/c1-4-8-16-11-19-13-18(15(2)3)14-21(20(19)12-16)17-9-6-5-7-10-17/h5-7,9-10,12-15H,4,8,11H2,1-3H3
InChIKeyBQPZBCQVHBYVPB-UHFFFAOYSA-N
XLogP6.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.42
LogP ≤ 56.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(2-butyl-6-propan-2-yl-1H-inden-4-yl)naphthalene
CID 161273622
5-phenyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
CID 87703779
2-butyl-4-(2-phenylphenyl)-1H-indene
CID 154024612
5-methyl-4-(2-propan-2-ylphenyl)-2-propyl-1H-indene
CID 87702540
5-tert-butyl-4-(2-phenylphenyl)-2-propyl-1H-indene
CID 87702713
5-ethyl-4-phenyl-2-propyl-1H-indene
CID 87703151
2,6-diphenyl-4-propan-2-ylphenol
CID 155045328
2-(2-methylpropyl)-4-phenyl-5-propyl-1H-indene
CID 87703739
3-(2-propyl-1H-inden-4-yl)quinoline
CID 159825483
2,6-diphenyl-4-propan-2-ylbenzonitrile
CID 139441487
2,6-dimethyl-4-(4-propylphenyl)-1H-indene
CID 87521295
2-hexyl-4-(4-propylphenyl)-1H-indene
CID 22507887

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-6-propan-2-yl-2-propyl-1H-indene?
The IUPAC name of 4-phenyl-6-propan-2-yl-2-propyl-1H-indene (CID 158001235) is 4-phenyl-6-propan-2-yl-2-propyl-1H-indene.
What is the SMILES notation for 4-phenyl-6-propan-2-yl-2-propyl-1H-indene?
The canonical SMILES for 4-phenyl-6-propan-2-yl-2-propyl-1H-indene is CCCC1=Cc2c(cc(C(C)C)cc2-c2ccccc2)C1.
What is the InChIKey of 4-phenyl-6-propan-2-yl-2-propyl-1H-indene?
The InChIKey is BQPZBCQVHBYVPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24/c1-4-8-16-11-19-13-18(15(2)3)14-21(20(19)12-16)17-9-6-5-7-10-17/h5-7,9-10,12-15H,4,8,11H2,1-3H3.
What are the key properties of 4-phenyl-6-propan-2-yl-2-propyl-1H-indene?
4-phenyl-6-propan-2-yl-2-propyl-1H-indene has a molecular weight of 276.42 g/mol, XLogP of 6.22, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-6-propan-2-yl-2-propyl-1H-indene is sourced from PubChem (CID 158001235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).