4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene

C21H24 — CID 87703711

IUPAC4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene
SMILESCC1=Cc2c(ccc(C(C)C)c2-c2cc(C)cc(C)c2)C1
InChIInChI=1S/C21H24/c1-13(2)19-7-6-17-9-16(5)12-20(17)21(19)18-10-14(3)8-15(4)11-18/h6-8,10-13H,9H2,1-5H3
InChIKeyDPXOSSUROYJYMJ-UHFFFAOYSA-N
MW276.42 g/mol
LogP6.05
Rot. Bonds2

About 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene

4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene (PubChem CID 87703711) has the molecular formula C21H24 and a molecular weight of 276.42 g/mol. Its IUPAC name is 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene.

Molecular Properties

Compound Name4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene
PubChem CID87703711
Molecular FormulaC21H24
Molecular Weight276.42 g/mol
Exact Mass276.19
IUPAC Name4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene
SMILESCC1=Cc2c(ccc(C(C)C)c2-c2cc(C)cc(C)c2)C1
InChIInChI=1S/C21H24/c1-13(2)19-7-6-17-9-16(5)12-20(17)21(19)18-10-14(3)8-15(4)11-18/h6-8,10-13H,9H2,1-5H3
InChIKeyDPXOSSUROYJYMJ-UHFFFAOYSA-N
XLogP6.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.42
LogP ≤ 56.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene
CID 87703077
4-[3,5-bis(trifluoromethyl)phenyl]-2-(2-methylpropyl)-5-propan-2-yl-1H-indene
CID 87703074
4-(3,5-dimethylphenyl)-2,5-diphenyl-1H-indene
CID 87702697
2,5-dimethyl-4-phenyl-1H-indene
CID 173229793
2-(3,5-dimethylphenyl)-1,3,5-tri(propan-2-yl)benzene
CID 123164700
2,7-dimethyl-4,6-di(propan-2-yl)-1H-indene
CID 22602468
2-bromo-4-[3,5-di(propan-2-yl)phenyl]-5-methyl-1H-indene
CID 67328501
2-butyl-4-(3,5-dimethylphenyl)-5-ethyl-1H-indene
CID 87703373
2-butyl-5-propan-2-yl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703016
4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene
CID 173192637
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

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene?
The IUPAC name of 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene (CID 87703711) is 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene.
What is the SMILES notation for 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene?
The canonical SMILES for 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene is CC1=Cc2c(ccc(C(C)C)c2-c2cc(C)cc(C)c2)C1.
What is the InChIKey of 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene?
The InChIKey is DPXOSSUROYJYMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24/c1-13(2)19-7-6-17-9-16(5)12-20(17)21(19)18-10-14(3)8-15(4)11-18/h6-8,10-13H,9H2,1-5H3.
What are the key properties of 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene?
4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene has a molecular weight of 276.42 g/mol, XLogP of 6.05, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene is sourced from PubChem (CID 87703711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).