5-(9H-fluoren-2-ylmethyl)-1H-imidazole

C17H14N2 — CID 67618463

IUPAC5-(9H-fluoren-2-ylmethyl)-1H-imidazole
SMILESc1ccc2c(c1)Cc1cc(Cc3cnc[nH]3)ccc1-2
InChIInChI=1S/C17H14N2/c1-2-4-16-13(3-1)9-14-7-12(5-6-17(14)16)8-15-10-18-11-19-15/h1-7,10-11H,8-9H2,(H,18,19)
InChIKeyHEAJLPJWIZNVCU-UHFFFAOYSA-N
MW246.31 g/mol
LogP3.57
Rot. Bonds2

About 5-(9H-fluoren-2-ylmethyl)-1H-imidazole

5-(9H-fluoren-2-ylmethyl)-1H-imidazole (PubChem CID 67618463) has the molecular formula C17H14N2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-(9H-fluoren-2-ylmethyl)-1H-imidazole.

Molecular Properties

Compound Name5-(9H-fluoren-2-ylmethyl)-1H-imidazole
PubChem CID67618463
Molecular FormulaC17H14N2
Molecular Weight246.31 g/mol
Exact Mass246.12
IUPAC Name5-(9H-fluoren-2-ylmethyl)-1H-imidazole
SMILESc1ccc2c(c1)Cc1cc(Cc3cnc[nH]3)ccc1-2
InChIInChI=1S/C17H14N2/c1-2-4-16-13(3-1)9-14-7-12(5-6-17(14)16)8-15-10-18-11-19-15/h1-7,10-11H,8-9H2,(H,18,19)
InChIKeyHEAJLPJWIZNVCU-UHFFFAOYSA-N
XLogP3.57
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[(3,5-diethylphenyl)methyl]-9H-fluorene
CID 167699473
2-(fluoromethyl)-9H-fluorene
CID 126607350
9H-fluoren-2-ylmethyl(trimethyl)silane
CID 132540419
3-benzyl-9H-fluorene
CID 57310019
5-[(3-fluorophenyl)methyl]-1H-imidazole;hydrochloride
CID 122163567
N-(9H-fluoren-2-ylmethyl)methanimine
CID 142569253
cadmium;9H-fluorene
CID 175337736
2-[4-[(3-phenylphenyl)methyl]phenyl]-9H-fluorene
CID 142614829
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-hexyl-9H-fluorene
CID 2801684
2-decyl-9H-fluorene
CID 21095311
1-[2-(9H-fluoren-2-yl)ethyl]imidazole;hydrochloride
CID 67640452

Frequently Asked Questions

What is the IUPAC name of 5-(9H-fluoren-2-ylmethyl)-1H-imidazole?
The IUPAC name of 5-(9H-fluoren-2-ylmethyl)-1H-imidazole (CID 67618463) is 5-(9H-fluoren-2-ylmethyl)-1H-imidazole.
What is the SMILES notation for 5-(9H-fluoren-2-ylmethyl)-1H-imidazole?
The canonical SMILES for 5-(9H-fluoren-2-ylmethyl)-1H-imidazole is c1ccc2c(c1)Cc1cc(Cc3cnc[nH]3)ccc1-2.
What is the InChIKey of 5-(9H-fluoren-2-ylmethyl)-1H-imidazole?
The InChIKey is HEAJLPJWIZNVCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2/c1-2-4-16-13(3-1)9-14-7-12(5-6-17(14)16)8-15-10-18-11-19-15/h1-7,10-11H,8-9H2,(H,18,19).
What are the key properties of 5-(9H-fluoren-2-ylmethyl)-1H-imidazole?
5-(9H-fluoren-2-ylmethyl)-1H-imidazole has a molecular weight of 246.31 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(9H-fluoren-2-ylmethyl)-1H-imidazole is sourced from PubChem (CID 67618463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).