2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene

C26H30 — CID 100983243

IUPAC2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene
SMILESC=C1Cc2ccccc2C1(CC1=C(C(C)C)c2ccccc2C1)C(C)C
InChIInChI=1S/C26H30/c1-17(2)25-22(15-20-10-6-8-12-23(20)25)16-26(18(3)4)19(5)14-21-11-7-9-13-24(21)26/h6-13,17-18H,5,14-16H2,1-4H3
InChIKeyTXELEWYAKWWBSO-UHFFFAOYSA-N
MW342.53 g/mol
LogP6.75
Rot. Bonds4

About 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene

2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene (PubChem CID 100983243) has the molecular formula C26H30 and a molecular weight of 342.53 g/mol. Its IUPAC name is 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene.

Molecular Properties

Compound Name2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene
PubChem CID100983243
Molecular FormulaC26H30
Molecular Weight342.53 g/mol
Exact Mass342.23
IUPAC Name2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene
SMILESC=C1Cc2ccccc2C1(CC1=C(C(C)C)c2ccccc2C1)C(C)C
InChIInChI=1S/C26H30/c1-17(2)25-22(15-20-10-6-8-12-23(20)25)16-26(18(3)4)19(5)14-21-11-7-9-13-24(21)26/h6-13,17-18H,5,14-16H2,1-4H3
InChIKeyTXELEWYAKWWBSO-UHFFFAOYSA-N
XLogP6.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.53
LogP ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene with MolForge

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Related Compounds

ethane;3-ethyl-3-propan-2-yl-1H-inden-2-one
CID 177033709
9-ethyl-9-propan-2-ylfluorene
CID 142424661
3,3-dimethyl-2-methylidene-1H-indene;ethane
CID 143953753
ethane;spiro[9H-anthracene-10,9'-fluorene]
CID 90717340
[3-(2-methylpropyl)-1H-inden-2-yl]methanol
CID 11052697
2-methylidenespiro[1H-indene-3,4'-piperidine]
CID 176678047
butane;ethanamine;ethane;bis(spiro[9H-anthracene-10,9'-fluorene])
CID 165034994
8,9-dibutyltricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,8,11,13-heptaene
CID 102005238
2-[1-[9-[1-(oxiran-2-yl)ethyl]fluoren-9-yl]ethyl]oxirane
CID 139994136
9H-fluorene;propane-1,2-diol
CID 158061143
ethene;9H-fluorene
CID 159544077
7-phenyl-2-[2-(7-phenyl-3-propan-2-yl-1H-inden-2-yl)ethyl]-3-propan-2-yl-1H-indene
CID 20656351

Frequently Asked Questions

What is the IUPAC name of 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene?
The IUPAC name of 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene (CID 100983243) is 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene.
What is the SMILES notation for 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene?
The canonical SMILES for 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene is C=C1Cc2ccccc2C1(CC1=C(C(C)C)c2ccccc2C1)C(C)C.
What is the InChIKey of 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene?
The InChIKey is TXELEWYAKWWBSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30/c1-17(2)25-22(15-20-10-6-8-12-23(20)25)16-26(18(3)4)19(5)14-21-11-7-9-13-24(21)26/h6-13,17-18H,5,14-16H2,1-4H3.
What are the key properties of 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene?
2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene has a molecular weight of 342.53 g/mol, XLogP of 6.75, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidene-3-propan-2-yl-3-[(3-propan-2-yl-1H-inden-2-yl)methyl]-1H-indene is sourced from PubChem (CID 100983243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).