4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol

C15H17FN2O — CID 116881267

IUPAC4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol
SMILESOC1CCC(c2ncc(-c3ccc(F)cc3)[nH]2)CC1
InChIInChI=1S/C15H17FN2O/c16-12-5-1-10(2-6-12)14-9-17-15(18-14)11-3-7-13(19)8-4-11/h1-2,5-6,9,11,13,19H,3-4,7-8H2,(H,17,18)
InChIKeyMVEGTRWIWSFSFZ-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.23
Rot. Bonds2

About 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol

4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol (PubChem CID 116881267) has the molecular formula C15H17FN2O and a molecular weight of 260.31 g/mol. Its IUPAC name is 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol
PubChem CID116881267
Molecular FormulaC15H17FN2O
Molecular Weight260.31 g/mol
Exact Mass260.13
IUPAC Name4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol
SMILESOC1CCC(c2ncc(-c3ccc(F)cc3)[nH]2)CC1
InChIInChI=1S/C15H17FN2O/c16-12-5-1-10(2-6-12)14-9-17-15(18-14)11-3-7-13(19)8-4-11/h1-2,5-6,9,11,13,19H,3-4,7-8H2,(H,17,18)
InChIKeyMVEGTRWIWSFSFZ-UHFFFAOYSA-N
XLogP3.23
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol?
The IUPAC name of 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol (CID 116881267) is 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol?
The canonical SMILES for 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol is OC1CCC(c2ncc(-c3ccc(F)cc3)[nH]2)CC1.
What is the InChIKey of 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol?
The InChIKey is MVEGTRWIWSFSFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O/c16-12-5-1-10(2-6-12)14-9-17-15(18-14)11-3-7-13(19)8-4-11/h1-2,5-6,9,11,13,19H,3-4,7-8H2,(H,17,18).
What are the key properties of 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol?
4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol has a molecular weight of 260.31 g/mol, XLogP of 3.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 116881267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).