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

C22H26 — CID 87703077

IUPAC4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene
SMILESCCc1ccc2c(c1-c1cc(C)cc(C)c1)C=C(C(C)C)C2
InChIInChI=1S/C22H26/c1-6-17-7-8-18-12-19(14(2)3)13-21(18)22(17)20-10-15(4)9-16(5)11-20/h7-11,13-14H,6,12H2,1-5H3
InChIKeyOTXMOOSSCTYEJC-UHFFFAOYSA-N
MW290.45 g/mol
LogP6.13
Rot. Bonds3

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

4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene (PubChem CID 87703077) has the molecular formula C22H26 and a molecular weight of 290.45 g/mol. Its IUPAC name is 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene.

Molecular Properties

Compound Name4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene
PubChem CID87703077
Molecular FormulaC22H26
Molecular Weight290.45 g/mol
Exact Mass290.20
IUPAC Name4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene
SMILESCCc1ccc2c(c1-c1cc(C)cc(C)c1)C=C(C(C)C)C2
InChIInChI=1S/C22H26/c1-6-17-7-8-18-12-19(14(2)3)13-21(18)22(17)20-10-15(4)9-16(5)11-20/h7-11,13-14H,6,12H2,1-5H3
InChIKeyOTXMOOSSCTYEJC-UHFFFAOYSA-N
XLogP6.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.45
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[3-(5-ethyl-2-propan-2-yl-1H-inden-4-yl)-5-trimethylsilylphenyl]-trimethylsilane
CID 87703672
2-butyl-4-(3,5-dimethylphenyl)-5-ethyl-1H-indene
CID 87703373
4-ethyl-2-propan-2-yl-1H-indene
CID 87400054
4-(3,5-dimethylphenyl)-2-methyl-5-propan-2-yl-1H-indene
CID 87703711
2-butan-2-yl-5-ethyl-4-(2-propan-2-ylphenyl)-1H-indene
CID 87703689
5-tert-butyl-4-(3,5-ditert-butylphenyl)-2-propan-2-yl-1H-indene
CID 87703601
[3-(2-butan-2-yl-5-propyl-1H-inden-4-yl)-5-trimethylsilylphenyl]-trimethylsilane
CID 87702898
2-[4-[3,5-bis(trifluoromethyl)phenyl]-5-ethyl-1H-inden-2-yl]-5-methylfuran
CID 87358907
5-phenyl-4-(2-phenylphenyl)-2-propan-2-yl-1H-indene
CID 87703693
4-methyl-2-propan-2-yl-1H-indene
CID 87188537
5-ethyl-4-phenyl-2-propyl-1H-indene
CID 87703151
5-ethyl-4-(2-ethylphenyl)-2-methyl-1H-indene
CID 87702809

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene?
The IUPAC name of 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene (CID 87703077) is 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene.
What is the SMILES notation for 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene?
The canonical SMILES for 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene is CCc1ccc2c(c1-c1cc(C)cc(C)c1)C=C(C(C)C)C2.
What is the InChIKey of 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene?
The InChIKey is OTXMOOSSCTYEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26/c1-6-17-7-8-18-12-19(14(2)3)13-21(18)22(17)20-10-15(4)9-16(5)11-20/h7-11,13-14H,6,12H2,1-5H3.
What are the key properties of 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene?
4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene has a molecular weight of 290.45 g/mol, XLogP of 6.13, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylphenyl)-5-ethyl-2-propan-2-yl-1H-indene is sourced from PubChem (CID 87703077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).