2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene

C19H20 — CID 87521684

IUPAC2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene
SMILESCCC1=Cc2c(-c3ccc(C)cc3)ccc(C)c2C1
InChIInChI=1S/C19H20/c1-4-15-11-18-14(3)7-10-17(19(18)12-15)16-8-5-13(2)6-9-16/h5-10,12H,4,11H2,1-3H3
InChIKeyAGHJEMRUTUKKMR-UHFFFAOYSA-N
MW248.37 g/mol
LogP5.32
Rot. Bonds2

About 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene

2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene (PubChem CID 87521684) has the molecular formula C19H20 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene.

Molecular Properties

Compound Name2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene
PubChem CID87521684
Molecular FormulaC19H20
Molecular Weight248.37 g/mol
Exact Mass248.16
IUPAC Name2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene
SMILESCCC1=Cc2c(-c3ccc(C)cc3)ccc(C)c2C1
InChIInChI=1S/C19H20/c1-4-15-11-18-14(3)7-10-17(19(18)12-15)16-8-5-13(2)6-9-16/h5-10,12H,4,11H2,1-3H3
InChIKeyAGHJEMRUTUKKMR-UHFFFAOYSA-N
XLogP5.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500248.37
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-(3,4-dimethylphenyl)-2-ethyl-7-methyl-1H-indene
CID 87984166
dichlorozirconium;2-ethyl-4,7-dimethyl-1H-indene
CID 174363313
2-benzyl-7-methyl-4-phenyl-1H-indene
CID 87188010
4-(4-tert-butylphenyl)-7-methyl-2-pentyl-1H-indene
CID 87188884
2-ethyl-7-(4-methylphenyl)-1H-indene
CID 57273568
2-(cyclohexylmethyl)-4,7-bis(4-methylphenyl)-1H-indene
CID 87142380
2-(cyclohexylmethyl)-7-methyl-4-(4-propan-2-ylphenyl)-1H-indene
CID 87476067
2-butyl-4,7-bis(3,5-dimethylphenyl)-1H-indene
CID 87142110
2-ethyl-4,5,6,7-tetramethyl-1H-indene
CID 22463170
4,7-bis(4-tert-butylphenyl)-2-(2,2-dimethylpropyl)-1H-indene
CID 173016294
1-(2,4-diethylcyclopenta-1,4-dien-1-yl)-4-methylbenzene
CID 139929586
1,6-dimethylazulene
CID 10855725

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene?
The IUPAC name of 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene (CID 87521684) is 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene.
What is the SMILES notation for 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene?
The canonical SMILES for 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene is CCC1=Cc2c(-c3ccc(C)cc3)ccc(C)c2C1.
What is the InChIKey of 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene?
The InChIKey is AGHJEMRUTUKKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20/c1-4-15-11-18-14(3)7-10-17(19(18)12-15)16-8-5-13(2)6-9-16/h5-10,12H,4,11H2,1-3H3.
What are the key properties of 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene?
2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene has a molecular weight of 248.37 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-7-methyl-4-(4-methylphenyl)-1H-indene is sourced from PubChem (CID 87521684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).