2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene

C24H28 — CID 87473753

IUPAC2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene
SMILESCCc1ccc(-c2cccc3c2C=C(CC2CCCCC2)C3)cc1
InChIInChI=1S/C24H28/c1-2-18-11-13-21(14-12-18)23-10-6-9-22-16-20(17-24(22)23)15-19-7-4-3-5-8-19/h6,9-14,17,19H,2-5,7-8,15-16H2,1H3
InChIKeyMPCKJRCKOLMDTC-UHFFFAOYSA-N
MW316.49 g/mol
LogP6.83
Rot. Bonds4

About 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene

2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene (PubChem CID 87473753) has the molecular formula C24H28 and a molecular weight of 316.49 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene.

Molecular Properties

Compound Name2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene
PubChem CID87473753
Molecular FormulaC24H28
Molecular Weight316.49 g/mol
Exact Mass316.22
IUPAC Name2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene
SMILESCCc1ccc(-c2cccc3c2C=C(CC2CCCCC2)C3)cc1
InChIInChI=1S/C24H28/c1-2-18-11-13-21(14-12-18)23-10-6-9-22-16-20(17-24(22)23)15-19-7-4-3-5-8-19/h6,9-14,17,19H,2-5,7-8,15-16H2,1H3
InChIKeyMPCKJRCKOLMDTC-UHFFFAOYSA-N
XLogP6.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.49
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-(cycloheptylmethyl)-4-(4-propylphenyl)-1H-indene
CID 87475663
4-(4-tert-butylphenyl)-2-(cycloheptylmethyl)-1H-indene
CID 87474795
4-(4-cyclohexylphenyl)-2-(cyclopentylmethyl)-1H-indene
CID 87472369
4-(4-chlorophenyl)-2-ethyl-1H-indene
CID 18008260
2-(cyclohexylmethyl)-4,7-bis(4-methylphenyl)-1H-indene
CID 87142380
[4-[2-(cyclohexylmethyl)-6-methyl-1H-inden-4-yl]phenyl]-trimethylsilane
CID 87475329
2-hexyl-4-(4-propylphenyl)-1H-indene
CID 22507887
2-ethyl-4-(3-fluorophenyl)-1H-indene
CID 173192641
2-(cyclohexylmethyl)-7-methyl-4-(4-propan-2-ylphenyl)-1H-indene
CID 87476067
5-[[4-(2-ethyl-1H-inden-4-yl)phenyl]methyl]-2-methoxybenzenethiol
CID 173192624
2-cyclohexyl-4-(4-cyclohexylphenyl)-1H-indene
CID 87675897
[4-[2-[(1-ethylcyclononyl)methyl]-1H-inden-4-yl]phenyl]-trimethylsilane
CID 87381368

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene?
The IUPAC name of 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene (CID 87473753) is 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene.
What is the SMILES notation for 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene?
The canonical SMILES for 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene is CCc1ccc(-c2cccc3c2C=C(CC2CCCCC2)C3)cc1.
What is the InChIKey of 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene?
The InChIKey is MPCKJRCKOLMDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28/c1-2-18-11-13-21(14-12-18)23-10-6-9-22-16-20(17-24(22)23)15-19-7-4-3-5-8-19/h6,9-14,17,19H,2-5,7-8,15-16H2,1H3.
What are the key properties of 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene?
2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene has a molecular weight of 316.49 g/mol, XLogP of 6.83, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)-4-(4-ethylphenyl)-1H-indene is sourced from PubChem (CID 87473753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).