2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole

C24H28N2 — CID 118357276

IUPAC2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole
SMILESCC(C)(C)c1ccc2c(c1)Cc1cc(-c3cnc(C(C)(C)C)[nH]3)ccc1-2
InChIInChI=1S/C24H28N2/c1-23(2,3)18-8-10-20-17(13-18)12-16-11-15(7-9-19(16)20)21-14-25-22(26-21)24(4,5)6/h7-11,13-14H,12H2,1-6H3,(H,25,26)
InChIKeySIFPCYYYKILJHY-UHFFFAOYSA-N
MW344.50 g/mol
LogP6.24
Rot. Bonds1

About 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole

2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole (PubChem CID 118357276) has the molecular formula C24H28N2 and a molecular weight of 344.50 g/mol. Its IUPAC name is 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole.

Molecular Properties

Compound Name2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole
PubChem CID118357276
Molecular FormulaC24H28N2
Molecular Weight344.50 g/mol
Exact Mass344.23
IUPAC Name2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole
SMILESCC(C)(C)c1ccc2c(c1)Cc1cc(-c3cnc(C(C)(C)C)[nH]3)ccc1-2
InChIInChI=1S/C24H28N2/c1-23(2,3)18-8-10-20-17(13-18)12-16-11-15(7-9-19(16)20)21-14-25-22(26-21)24(4,5)6/h7-11,13-14H,12H2,1-6H3,(H,25,26)
InChIKeySIFPCYYYKILJHY-UHFFFAOYSA-N
XLogP6.24
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.50
LogP ≤ 56.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(2-tert-butyl-1H-imidazol-5-yl)-2-chloroaniline
CID 115046610
1-[5-[7-[2-(1-amino-2-methylpropyl)-1H-imidazol-5-yl]-9H-fluoren-2-yl]-1H-imidazol-2-yl]-2-methylpropan-1-amine
CID 123196921
2-[5-(4-tert-butylphenyl)-1H-imidazol-2-yl]propan-2-ol
CID 116881349
5-(3-bromophenyl)-2-tert-butyl-1H-imidazole
CID 59836686
bis(2-tert-butyl-5-(4-tert-butylphenyl)-1H-imidazole);bis(N-(4-tert-butylphenyl)-2,2-dimethylpropanamide);bis(2,6-ditert-butyl-3H-indole);ethane
CID 157175640
2-[7-(2-sulfanylpropan-2-yl)-9H-fluoren-2-yl]propane-2-thiol
CID 167021696
2-[5-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl]propan-2-amine
CID 65457057
2-tert-butyl-7-(4-tert-butyl-5,6-dimethylidenecyclohexa-1,3-dien-1-yl)-9H-fluorene;ethane
CID 144503486
2,6-ditert-butyl-9H-fluorene;dichlorotitanium
CID 174369876
4-(2-tert-butyl-1H-imidazol-5-yl)benzamide
CID 59836529
1-[5-[7-[2-(1-amino-2-methylpropyl)-1H-imidazol-5-yl]-9,10-dihydrophenanthren-2-yl]-1H-imidazol-2-yl]-2-methylpropan-1-amine
CID 123475669
3-(2-tert-butyl-1H-imidazol-5-yl)benzenecarboximidamide
CID 58290735

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole?
The IUPAC name of 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole (CID 118357276) is 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole.
What is the SMILES notation for 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole?
The canonical SMILES for 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole is CC(C)(C)c1ccc2c(c1)Cc1cc(-c3cnc(C(C)(C)C)[nH]3)ccc1-2.
What is the InChIKey of 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole?
The InChIKey is SIFPCYYYKILJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2/c1-23(2,3)18-8-10-20-17(13-18)12-16-11-15(7-9-19(16)20)21-14-25-22(26-21)24(4,5)6/h7-11,13-14H,12H2,1-6H3,(H,25,26).
What are the key properties of 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole?
2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole has a molecular weight of 344.50 g/mol, XLogP of 6.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-5-(7-tert-butyl-9H-fluoren-2-yl)-1H-imidazole is sourced from PubChem (CID 118357276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).