3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]

C24H22 — CID 58389877

IUPAC3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
SMILESCc1ccc(-c2ccc3c(c2)-c2ccccc2C32CCCC2)cc1
InChIInChI=1S/C24H22/c1-17-8-10-18(11-9-17)19-12-13-23-21(16-19)20-6-2-3-7-22(20)24(23)14-4-5-15-24/h2-3,6-13,16H,4-5,14-15H2,1H3
InChIKeyUEUUSKFGLMECBC-UHFFFAOYSA-N
MW310.44 g/mol
LogP6.50
Rot. Bonds1

About 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]

3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene] (PubChem CID 58389877) has the molecular formula C24H22 and a molecular weight of 310.44 g/mol. Its IUPAC name is 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene].

Molecular Properties

Compound Name3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
PubChem CID58389877
Molecular FormulaC24H22
Molecular Weight310.44 g/mol
Exact Mass310.17
IUPAC Name3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
SMILESCc1ccc(-c2ccc3c(c2)-c2ccccc2C32CCCC2)cc1
InChIInChI=1S/C24H22/c1-17-8-10-18(11-9-17)19-12-13-23-21(16-19)20-6-2-3-7-22(20)24(23)14-4-5-15-24/h2-3,6-13,16H,4-5,14-15H2,1H3
InChIKeyUEUUSKFGLMECBC-UHFFFAOYSA-N
XLogP6.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.44
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-phenyl-4-(4-phenylphenyl)-6-[4-[3-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(3-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159202142
3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
CID 166807935
2'-phenylspiro[cyclohexane-1,9'-fluorene]
CID 123183554
2-phenyl-4-(4-phenylphenyl)-6-[3-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]-1,3,5-triazine
CID 146352321
2-phenyl-4-(3-phenylphenyl)-6-[3-[4-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 162137850
4,6-diphenyl-2-[4-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]pyrimidine
CID 146352227
2-[4-methyl-3-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]-4,6-diphenylpyridine
CID 174327847
2-[4-[4-(6',6'-dimethylspiro[cyclohexane-1,12'-indeno[1,2-b]fluorene]-3'-yl)phenyl]phenyl]-3,5,6-triphenylpyrazine
CID 166902522
2-phenyl-4-(4-phenylphenyl)-6-[3-(3-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]pyrimidine
CID 159087005
9,9-dimethyl-3-[3-[4-(4-methylphenyl)phenyl]phenyl]fluorene
CID 156827523
2'-(6-spiro[cyclopentane-1,9'-fluorene]-2'-ylnaphthalen-2-yl)spiro[cyclopentane-1,9'-fluorene]
CID 58814373
2-[4-[3-(12',12'-dimethylspiro[cyclohexane-1,6'-indeno[1,2-b]fluorene]-3'-yl)phenyl]phenyl]-3,5,6-triphenylpyrazine
CID 166903120

Frequently Asked Questions

What is the IUPAC name of 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The IUPAC name of 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene] (CID 58389877) is 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene].
What is the SMILES notation for 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The canonical SMILES for 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene] is Cc1ccc(-c2ccc3c(c2)-c2ccccc2C32CCCC2)cc1.
What is the InChIKey of 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The InChIKey is UEUUSKFGLMECBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22/c1-17-8-10-18(11-9-17)19-12-13-23-21(16-19)20-6-2-3-7-22(20)24(23)14-4-5-15-24/h2-3,6-13,16H,4-5,14-15H2,1H3.
What are the key properties of 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene] has a molecular weight of 310.44 g/mol, XLogP of 6.50, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene] is sourced from PubChem (CID 58389877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).