2,9-dihydro-1H-cyclopenta[b]fluoren-3-one

C16H12O — CID 86042158

IUPAC2,9-dihydro-1H-cyclopenta[b]fluoren-3-one
SMILESO=C1CCc2cc3c(cc21)-c1ccccc1C3
InChIInChI=1S/C16H12O/c17-16-6-5-11-8-12-7-10-3-1-2-4-13(10)14(12)9-15(11)16/h1-4,8-9H,5-7H2
InChIKeyPPWCEAACSNNQFG-UHFFFAOYSA-N
MW220.27 g/mol
LogP3.39
Rot. Bonds

About 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one

2,9-dihydro-1H-cyclopenta[b]fluoren-3-one (PubChem CID 86042158) has the molecular formula C16H12O and a molecular weight of 220.27 g/mol. Its IUPAC name is 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one.

Molecular Properties

Compound Name2,9-dihydro-1H-cyclopenta[b]fluoren-3-one
PubChem CID86042158
Molecular FormulaC16H12O
Molecular Weight220.27 g/mol
Exact Mass220.09
IUPAC Name2,9-dihydro-1H-cyclopenta[b]fluoren-3-one
SMILESO=C1CCc2cc3c(cc21)-c1ccccc1C3
InChIInChI=1S/C16H12O/c17-16-6-5-11-8-12-7-10-3-1-2-4-13(10)14(12)9-15(11)16/h1-4,8-9H,5-7H2
InChIKeyPPWCEAACSNNQFG-UHFFFAOYSA-N
XLogP3.39
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
tetracyclo[9.7.0.03,9.012,17]octadeca-1(11),2,9,12,14,16-hexaene
CID 90965894
9H-fluorene;oxophosphane
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CID 161235205
2,3-dihydro-1H-indene;3,4-dihydro-2H-naphthalen-1-one;9H-fluorene;1,2,3,4-tetrahydronaphthalene
CID 158268251
9H-fluorene;oxozirconium
CID 174355249
chromium;9H-fluorene
CID 161167703
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914
9H-fluorene;trihydrofluoride
CID 172854917
9H-fluorene;3-iodo-9H-fluorene
CID 169429949
tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene-9,10-dione
CID 606622

Frequently Asked Questions

What is the IUPAC name of 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one?
The IUPAC name of 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one (CID 86042158) is 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one.
What is the SMILES notation for 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one?
The canonical SMILES for 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one is O=C1CCc2cc3c(cc21)-c1ccccc1C3.
What is the InChIKey of 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one?
The InChIKey is PPWCEAACSNNQFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12O/c17-16-6-5-11-8-12-7-10-3-1-2-4-13(10)14(12)9-15(11)16/h1-4,8-9H,5-7H2.
What are the key properties of 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one?
2,9-dihydro-1H-cyclopenta[b]fluoren-3-one has a molecular weight of 220.27 g/mol, XLogP of 3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-dihydro-1H-cyclopenta[b]fluoren-3-one is sourced from PubChem (CID 86042158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).