2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]

C23H26 — CID 178181319

IUPAC2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]
SMILESCC(C)c1ccc2c(c1)C1(CC=CC1)c1cc(C(C)C)ccc1-2
InChIInChI=1S/C23H26/c1-15(2)17-7-9-19-20-10-8-18(16(3)4)14-22(20)23(21(19)13-17)11-5-6-12-23/h5-10,13-16H,11-12H2,1-4H3
InChIKeyPVIPNLCLGGVRBZ-UHFFFAOYSA-N
MW302.46 g/mol
LogP6.55
Rot. Bonds2

About 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]

2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene] (PubChem CID 178181319) has the molecular formula C23H26 and a molecular weight of 302.46 g/mol. Its IUPAC name is 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene].

Molecular Properties

Compound Name2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]
PubChem CID178181319
Molecular FormulaC23H26
Molecular Weight302.46 g/mol
Exact Mass302.20
IUPAC Name2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]
SMILESCC(C)c1ccc2c(c1)C1(CC=CC1)c1cc(C(C)C)ccc1-2
InChIInChI=1S/C23H26/c1-15(2)17-7-9-19-20-10-8-18(16(3)4)14-22(20)23(21(19)13-17)11-5-6-12-23/h5-10,13-16H,11-12H2,1-4H3
InChIKeyPVIPNLCLGGVRBZ-UHFFFAOYSA-N
XLogP6.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.46
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-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

2'-tert-butyl-7'-propan-2-ylspiro[cyclopentane-1,9'-fluorene]
CID 170534798
2,7-di(propan-2-yl)spiro[fluorene-9,2'-thiane]
CID 90365446
2,7-di(propan-2-yl)-9,9-bis(prop-2-enyl)fluorene
CID 178181307
9,9-dibutyl-2,7-di(propan-2-yl)fluorene
CID 153392949
2-methyl-6-propan-2-ylspiro[3H-isoquinoline-4,1'-cyclopropane]-1-one
CID 171660016
9,9,10,10-tetramethyl-2,6-di(propan-2-yl)anthracene
CID 59611136
1-(4-propan-2-ylphenyl)cyclopent-3-en-1-amine
CID 65353110
(9S)-2-tert-butyl-9-methyl-7-propan-2-ylfluoren-9-ol
CID 130401999
3,3-dimethyl-2-methylidene-5-propan-2-yl-1H-indene
CID 157108603
1,1,3-trimethyl-5-propan-2-yl-3-(4-propan-2-ylphenyl)-2H-indene
CID 139620878
ethane;methane;6-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 160891896
1,4-dimethyl-6-propan-2-ylazulene
CID 19861187

Frequently Asked Questions

What is the IUPAC name of 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]?
The IUPAC name of 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene] (CID 178181319) is 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene].
What is the SMILES notation for 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]?
The canonical SMILES for 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene] is CC(C)c1ccc2c(c1)C1(CC=CC1)c1cc(C(C)C)ccc1-2.
What is the InChIKey of 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]?
The InChIKey is PVIPNLCLGGVRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26/c1-15(2)17-7-9-19-20-10-8-18(16(3)4)14-22(20)23(21(19)13-17)11-5-6-12-23/h5-10,13-16H,11-12H2,1-4H3.
What are the key properties of 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene]?
2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene] has a molecular weight of 302.46 g/mol, XLogP of 6.55, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2',7'-di(propan-2-yl)spiro[cyclopentene-4,9'-fluorene] is sourced from PubChem (CID 178181319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).