1-(9H-fluoren-9-yl)imidazole

C16H12N2 — CID 3828439

IUPAC1-(9H-fluoren-9-yl)imidazole
SMILESc1ccc2c(c1)-c1ccccc1C2n1ccnc1
InChIInChI=1S/C16H12N2/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)18-10-9-17-11-18/h1-11,16H
InChIKeyTULIZIRHYBBLAI-UHFFFAOYSA-N
MW232.29 g/mol
LogP3.50
Rot. Bonds1

About 1-(9H-fluoren-9-yl)imidazole

1-(9H-fluoren-9-yl)imidazole (PubChem CID 3828439) has the molecular formula C16H12N2 and a molecular weight of 232.29 g/mol. Its IUPAC name is 1-(9H-fluoren-9-yl)imidazole.

Molecular Properties

Compound Name1-(9H-fluoren-9-yl)imidazole
PubChem CID3828439
Molecular FormulaC16H12N2
Molecular Weight232.29 g/mol
Exact Mass232.10
IUPAC Name1-(9H-fluoren-9-yl)imidazole
SMILESc1ccc2c(c1)-c1ccccc1C2n1ccnc1
InChIInChI=1S/C16H12N2/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)18-10-9-17-11-18/h1-11,16H
InChIKeyTULIZIRHYBBLAI-UHFFFAOYSA-N
XLogP3.50
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-9-yl)imidazole?
The IUPAC name of 1-(9H-fluoren-9-yl)imidazole (CID 3828439) is 1-(9H-fluoren-9-yl)imidazole.
What is the SMILES notation for 1-(9H-fluoren-9-yl)imidazole?
The canonical SMILES for 1-(9H-fluoren-9-yl)imidazole is c1ccc2c(c1)-c1ccccc1C2n1ccnc1.
What is the InChIKey of 1-(9H-fluoren-9-yl)imidazole?
The InChIKey is TULIZIRHYBBLAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2/c1-3-7-14-12(5-1)13-6-2-4-8-15(13)16(14)18-10-9-17-11-18/h1-11,16H.
What are the key properties of 1-(9H-fluoren-9-yl)imidazole?
1-(9H-fluoren-9-yl)imidazole has a molecular weight of 232.29 g/mol, XLogP of 3.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-9-yl)imidazole is sourced from PubChem (CID 3828439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).