2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene

C21H20 — CID 90787993

IUPAC2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene
SMILESCCCC1c2ccccc2-c2ccc(C3=CC=CC3)cc21
InChIInChI=1S/C21H20/c1-2-7-17-18-10-5-6-11-19(18)20-13-12-16(14-21(17)20)15-8-3-4-9-15/h3-6,8,10-14,17H,2,7,9H2,1H3
InChIKeyCFLOKQPZCULDQG-UHFFFAOYSA-N
MW272.39 g/mol
LogP5.94
Rot. Bonds3

About 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene

2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene (PubChem CID 90787993) has the molecular formula C21H20 and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene.

Molecular Properties

Compound Name2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene
PubChem CID90787993
Molecular FormulaC21H20
Molecular Weight272.39 g/mol
Exact Mass272.16
IUPAC Name2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene
SMILESCCCC1c2ccccc2-c2ccc(C3=CC=CC3)cc21
InChIInChI=1S/C21H20/c1-2-7-17-18-10-5-6-11-19(18)20-13-12-16(14-21(17)20)15-8-3-4-9-15/h3-6,8,10-14,17H,2,7,9H2,1H3
InChIKeyCFLOKQPZCULDQG-UHFFFAOYSA-N
XLogP5.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.39
LogP ≤ 55.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-cyclopenta-1,3-dien-1-yl-9,9'-spirobi[fluorene]
CID 158389745
5,8-dibromo-2-phenyl-3-(9-propyl-9H-fluoren-2-yl)quinoxaline
CID 89469335
9-(cyclopenta-1,3-dien-1-ylmethyl)-2-ethyl-9H-fluorene
CID 57060482
9-[2-(9H-fluoren-9-yl)ethyl]-2,7-dinaphthalen-1-yl-9H-fluorene
CID 15494424
2-methyl-9-[2-(2-methyl-9H-fluoren-9-yl)ethyl]-9H-fluorene
CID 15494405
9-cyclopenta-1,3-dien-1-yl-6-(3-ethylhexyl)-3-methylidene-2,6-dihydro-1H-cyclopenta[c]fluorene;methane
CID 144788879
9-nonyl-9H-fluorene
CID 22568532
butylazanide;1-cyclopenta-1,3-dien-1-yl-2-propan-2-ylbenzene;titanium(2+);dihydrochloride
CID 87501379
9-(cyclopenta-1,3-dien-1-ylmethyl)-9H-fluorene;zirconium(2+);dichloride
CID 23443914
2-(6-cyclopenta-1,3-dien-1-yl-1H-inden-2-yl)-9H-fluorene
CID 155571314
1-cyclopenta-1,3-dien-1-yl-4-methylbenzene;toluene
CID 144640126
1,1'-biphenyl;1-cyclopenta-1,3-dien-1-yl-3-methylbenzene
CID 174397877

Frequently Asked Questions

What is the IUPAC name of 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene?
The IUPAC name of 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene (CID 90787993) is 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene.
What is the SMILES notation for 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene?
The canonical SMILES for 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene is CCCC1c2ccccc2-c2ccc(C3=CC=CC3)cc21.
What is the InChIKey of 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene?
The InChIKey is CFLOKQPZCULDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20/c1-2-7-17-18-10-5-6-11-19(18)20-13-12-16(14-21(17)20)15-8-3-4-9-15/h3-6,8,10-14,17H,2,7,9H2,1H3.
What are the key properties of 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene?
2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene has a molecular weight of 272.39 g/mol, XLogP of 5.94, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopenta-1,3-dien-1-yl-9-propyl-9H-fluorene is sourced from PubChem (CID 90787993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).