2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]

C32H26 — CID 142508879

IUPAC2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]
SMILESCc1ccc(-c2ccc3c(c2)C2(C4=C(CCC=C4)C4=C2CCC=C4)c2ccccc2-3)cc1
InChIInChI=1S/C32H26/c1-21-14-16-22(17-15-21)23-18-19-27-26-10-4-7-13-30(26)32(31(27)20-23)28-11-5-2-8-24(28)25-9-3-6-12-29(25)32/h2,4,6-8,10,12-20H,3,5,9,11H2,1H3
InChIKeyMTKFGAMBZLIPDW-UHFFFAOYSA-N
MW410.56 g/mol
LogP8.24
Rot. Bonds1

About 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]

2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] (PubChem CID 142508879) has the molecular formula C32H26 and a molecular weight of 410.56 g/mol. Its IUPAC name is 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene].

Molecular Properties

Compound Name2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]
PubChem CID142508879
Molecular FormulaC32H26
Molecular Weight410.56 g/mol
Exact Mass410.20
IUPAC Name2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]
SMILESCc1ccc(-c2ccc3c(c2)C2(C4=C(CCC=C4)C4=C2CCC=C4)c2ccccc2-3)cc1
InChIInChI=1S/C32H26/c1-21-14-16-22(17-15-21)23-18-19-27-26-10-4-7-13-30(26)32(31(27)20-23)28-11-5-2-8-24(28)25-9-3-6-12-29(25)32/h2,4,6-8,10,12-20H,3,5,9,11H2,1H3
InChIKeyMTKFGAMBZLIPDW-UHFFFAOYSA-N
XLogP8.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.56
LogP ≤ 58.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-4-phenylbenzene;2-methyl-9,9'-spirobi[fluorene];6,9,9-trimethyl-1,2-dihydrofluorene
CID 178165621
9-(9,9-diphenyl-7,8-dihydrofluoren-2-yl)-9-(4-methylphenyl)fluorene
CID 145328119
N-phenyl-N-[4-[4-(N-spiro[5,6-dihydrofluorene-9,9'-fluorene]-2-ylanilino)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 143240280
3'-methylspiro[3,4-dihydrobenzo[b]fluorene-11,11'-benzo[a]fluorene]
CID 163841303
2-[6-[7'-(4-methylphenyl)-9,9'-spirobi[fluorene]-2'-yl]naphthalen-2-yl]-3-phenyl-4,5-dihydrobenzimidazole
CID 70666907
9,9-dimethyl-2-[4-methyl-3-(2-methylcyclohexa-1,5-dien-1-yl)phenyl]fluorene
CID 145212388
N-(4-phenylphenyl)spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-amine
CID 166861507
9,9-dimethyl-10-naphthalen-1-yl-2-spiro[5,6-dihydrofluorene-9,9'-fluorene]-2-ylacridine
CID 90087290
1-N-(7'-methyl-9,9'-spirobi[fluorene]-2'-yl)-4-N-spiro[1,2-dihydrofluorene-9,9'-fluorene]-2'-ylbenzene-1,4-diamine oxide
CID 163766448
7-[phenyl(spiro[3,4-dihydrofluorene-9,9'-fluorene]-2'-yl)phosphoryl]spiro[3,4-dihydrofluorene-9,9'-fluorene]
CID 129311396
ethane;(4-methylcyclohexa-2,4-dien-1-yl)benzene;2'-[4-(4-methylphenyl)phenyl]spiro[3,4-dihydrofluorene-9,9'-fluorene];6-methyl-1,2,11,12-tetrahydrotriphenylene;propane
CID 145204090
[7'-(9,9'-spirobi[fluorene]-2-carbonyl)spiro[3,4-dihydrofluorene-9,9'-fluorene]-2'-yl]-(9,9'-spirobi[fluorene]-2-yl)methanone
CID 88890935

Frequently Asked Questions

What is the IUPAC name of 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]?
The IUPAC name of 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] (CID 142508879) is 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene].
What is the SMILES notation for 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]?
The canonical SMILES for 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] is Cc1ccc(-c2ccc3c(c2)C2(C4=C(CCC=C4)C4=C2CCC=C4)c2ccccc2-3)cc1.
What is the InChIKey of 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]?
The InChIKey is MTKFGAMBZLIPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H26/c1-21-14-16-22(17-15-21)23-18-19-27-26-10-4-7-13-30(26)32(31(27)20-23)28-11-5-2-8-24(28)25-9-3-6-12-29(25)32/h2,4,6-8,10,12-20H,3,5,9,11H2,1H3.
What are the key properties of 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene]?
2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] has a molecular weight of 410.56 g/mol, XLogP of 8.24, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2'-(4-methylphenyl)spiro[1,2,5,6-tetrahydrofluorene-9,9'-fluorene] is sourced from PubChem (CID 142508879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).