5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole

C19H18F2N2 — CID 10757477

IUPAC5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole
SMILESFc1ccc(CCC(Cc2cnc[nH]2)c2ccc(F)cc2)cc1
InChIInChI=1S/C19H18F2N2/c20-17-7-2-14(3-8-17)1-4-16(11-19-12-22-13-23-19)15-5-9-18(21)10-6-15/h2-3,5-10,12-13,16H,1,4,11H2,(H,22,23)
InChIKeyQHJCFHQSUYYMAR-UHFFFAOYSA-N
MW312.36 g/mol
LogP4.65
Rot. Bonds6

About 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole

5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole (PubChem CID 10757477) has the molecular formula C19H18F2N2 and a molecular weight of 312.36 g/mol. Its IUPAC name is 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole.

Molecular Properties

Compound Name5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole
PubChem CID10757477
Molecular FormulaC19H18F2N2
Molecular Weight312.36 g/mol
Exact Mass312.14
IUPAC Name5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole
SMILESFc1ccc(CCC(Cc2cnc[nH]2)c2ccc(F)cc2)cc1
InChIInChI=1S/C19H18F2N2/c20-17-7-2-14(3-8-17)1-4-16(11-19-12-22-13-23-19)15-5-9-18(21)10-6-15/h2-3,5-10,12-13,16H,1,4,11H2,(H,22,23)
InChIKeyQHJCFHQSUYYMAR-UHFFFAOYSA-N
XLogP4.65
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.36
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-amino-N-[2-(4-fluorophenyl)ethyl]-3-(1H-imidazol-5-yl)propanamide
CID 156533963
5-(2,3-diphenylpropyl)-1H-imidazole
CID 10491736
4-[1,5-bis(4-fluorophenyl)pentan-3-yl]-3-methylpyridine
CID 10831764
5-[4-[2-(4-fluorophenyl)phenyl]-3-[1-[2-(4-fluorophenyl)phenyl]-4-(1H-imidazol-5-yl)butan-2-yl]oxybutyl]-1H-imidazole
CID 69023347
(3S)-3-amino-1-(4-fluorophenyl)sulfanyl-4-(1H-imidazol-5-yl)butan-2-one
CID 90666279
1-[2-(4-fluorophenyl)-4-(4-methylphenyl)butyl]-1,2,4-triazole;hydrochloride
CID 23315452
1-(4-butylphenyl)-N-[2-(1H-imidazol-5-yl)ethyl]ethanamine
CID 65230971
1-(1H-imidazol-5-yl)-3,5-diphenylpentan-1-one
CID 173345810
3-(4-fluorophenyl)-1-pyridin-3-ylpropan-1-ol
CID 19775361
5-[4,4-bis(4-methylphenyl)butyl]-1H-imidazole
CID 10780854
5-(2,3-dimethylbutyl)-1H-imidazole
CID 149460105
1-[1-bromo-3-(4-fluorophenyl)propan-2-yl]-4-fluorobenzene
CID 79435525

Frequently Asked Questions

What is the IUPAC name of 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole?
The IUPAC name of 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole (CID 10757477) is 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole.
What is the SMILES notation for 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole?
The canonical SMILES for 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole is Fc1ccc(CCC(Cc2cnc[nH]2)c2ccc(F)cc2)cc1.
What is the InChIKey of 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole?
The InChIKey is QHJCFHQSUYYMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2/c20-17-7-2-14(3-8-17)1-4-16(11-19-12-22-13-23-19)15-5-9-18(21)10-6-15/h2-3,5-10,12-13,16H,1,4,11H2,(H,22,23).
What are the key properties of 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole?
5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole has a molecular weight of 312.36 g/mol, XLogP of 4.65, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2,4-bis(4-fluorophenyl)butyl]-1H-imidazole is sourced from PubChem (CID 10757477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).