3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene

C17H16 — CID 123494676

IUPAC3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene
SMILESCC1CCc2cc3c(cc21)-c1ccccc1C3
InChIInChI=1S/C17H16/c1-11-6-7-13-9-14-8-12-4-2-3-5-15(12)17(14)10-16(11)13/h2-5,9-11H,6-8H2,1H3
InChIKeyFCRSLEYDLZBYFY-UHFFFAOYSA-N
MW220.31 g/mol
LogP4.31
Rot. Bonds

About 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene

3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene (PubChem CID 123494676) has the molecular formula C17H16 and a molecular weight of 220.31 g/mol. Its IUPAC name is 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene.

Molecular Properties

Compound Name3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene
PubChem CID123494676
Molecular FormulaC17H16
Molecular Weight220.31 g/mol
Exact Mass220.13
IUPAC Name3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene
SMILESCC1CCc2cc3c(cc21)-c1ccccc1C3
InChIInChI=1S/C17H16/c1-11-6-7-13-9-14-8-12-4-2-3-5-15(12)17(14)10-16(11)13/h2-5,9-11H,6-8H2,1H3
InChIKeyFCRSLEYDLZBYFY-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.31
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

undecacyclo[13.13.13.02,14.04,12.05,10.016,28.018,26.020,25.029,41.031,39.032,37]hentetraconta-2(14),3,5,7,9,12,16(28),17,20,22,24,26,29(41),30,32,34,36,39-octadecaene
CID 132604363
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
2,3-dicyclohexyl-9H-fluorene
CID 21095222
chromium;9H-fluorene
CID 161167703
10-methyl-10,12-dihydroindeno[2,1-b]fluorene
CID 157251176
tetracyclo[9.7.0.03,9.012,17]octadeca-1(11),2,9,12,14,16-hexaene
CID 90965894
2-methyl-2-azaheptacyclo[15.11.0.03,15.05,13.06,11.019,27.021,26]octacosa-1(17),3(15),4,6,8,10,13,18,21,23,25,27-dodecaene
CID 162243308
bicyclo[4.2.0]octa-1,3,5-triene;9H-fluorene
CID 161235205
9H-fluorene;oxophosphane
CID 174601741
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914
9H-fluorene;trihydrofluoride
CID 172854917

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene?
The IUPAC name of 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene (CID 123494676) is 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene.
What is the SMILES notation for 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene?
The canonical SMILES for 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene is CC1CCc2cc3c(cc21)-c1ccccc1C3.
What is the InChIKey of 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene?
The InChIKey is FCRSLEYDLZBYFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16/c1-11-6-7-13-9-14-8-12-4-2-3-5-15(12)17(14)10-16(11)13/h2-5,9-11H,6-8H2,1H3.
What are the key properties of 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene?
3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene has a molecular weight of 220.31 g/mol, XLogP of 4.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,2,3,9-tetrahydrocyclopenta[b]fluorene is sourced from PubChem (CID 123494676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).