3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene

C19H18 — CID 160928129

IUPAC3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene
SMILESCc1cc2c(c3c1C(C)C=C3)C(C)c1ccccc1-2
InChIInChI=1S/C19H18/c1-11-8-9-16-18(11)12(2)10-17-15-7-5-4-6-14(15)13(3)19(16)17/h4-11,13H,1-3H3
InChIKeyXJIUJYUTQJOFSU-UHFFFAOYSA-N
MW246.35 g/mol
LogP5.26
Rot. Bonds

About 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene

3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene (PubChem CID 160928129) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene.

Molecular Properties

Compound Name3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene
PubChem CID160928129
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene
SMILESCc1cc2c(c3c1C(C)C=C3)C(C)c1ccccc1-2
InChIInChI=1S/C19H18/c1-11-8-9-16-18(11)12(2)10-17-15-7-5-4-6-14(15)13(3)19(16)17/h4-11,13H,1-3H3
InChIKeyXJIUJYUTQJOFSU-UHFFFAOYSA-N
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.35
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene?
The IUPAC name of 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene (CID 160928129) is 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene.
What is the SMILES notation for 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene?
The canonical SMILES for 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene is Cc1cc2c(c3c1C(C)C=C3)C(C)c1ccccc1-2.
What is the InChIKey of 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene?
The InChIKey is XJIUJYUTQJOFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-11-8-9-16-18(11)12(2)10-17-15-7-5-4-6-14(15)13(3)19(16)17/h4-11,13H,1-3H3.
What are the key properties of 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene?
3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene has a molecular weight of 246.35 g/mol, XLogP of 5.26, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,10-trimethyl-3,10-dihydrocyclopenta[a]fluorene is sourced from PubChem (CID 160928129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).