2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride

C16H14ClFN2O — CID 18673126

IUPAC2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride
SMILESCOc1ccc(-c2cnc(-c3ccc(F)cc3)[nH]2)cc1.Cl
InChIInChI=1S/C16H13FN2O.ClH/c1-20-14-8-4-11(5-9-14)15-10-18-16(19-15)12-2-6-13(17)7-3-12;/h2-10H,1H3,(H,18,19);1H
InChIKeyRTSFSSMJQMDMQF-UHFFFAOYSA-N
MW304.75 g/mol
LogP4.31
Rot. Bonds3

About 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride

2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride (PubChem CID 18673126) has the molecular formula C16H14ClFN2O and a molecular weight of 304.75 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride
PubChem CID18673126
Molecular FormulaC16H14ClFN2O
Molecular Weight304.75 g/mol
Exact Mass304.08
IUPAC Name2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride
SMILESCOc1ccc(-c2cnc(-c3ccc(F)cc3)[nH]2)cc1.Cl
InChIInChI=1S/C16H13FN2O.ClH/c1-20-14-8-4-11(5-9-14)15-10-18-16(19-15)12-2-6-13(17)7-3-12;/h2-10H,1H3,(H,18,19);1H
InChIKeyRTSFSSMJQMDMQF-UHFFFAOYSA-N
XLogP4.31
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.75
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride?
The IUPAC name of 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride (CID 18673126) is 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride.
What is the SMILES notation for 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride?
The canonical SMILES for 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride is COc1ccc(-c2cnc(-c3ccc(F)cc3)[nH]2)cc1.Cl.
What is the InChIKey of 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride?
The InChIKey is RTSFSSMJQMDMQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O.ClH/c1-20-14-8-4-11(5-9-14)15-10-18-16(19-15)12-2-6-13(17)7-3-12;/h2-10H,1H3,(H,18,19);1H.
What are the key properties of 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride?
2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride has a molecular weight of 304.75 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-(4-methoxyphenyl)-1H-imidazole;hydrochloride is sourced from PubChem (CID 18673126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).