2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol

C14H17FN2O — CID 22763069

IUPAC2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol
SMILESCC(O)(CCCn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C14H17FN2O/c1-14(18,12-3-5-13(15)6-4-12)7-2-9-17-10-8-16-11-17/h3-6,8,10-11,18H,2,7,9H2,1H3
InChIKeyLNLFWAHKOJUFBM-UHFFFAOYSA-N
MW248.30 g/mol
LogP2.71
Rot. Bonds5

About 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol

2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol (PubChem CID 22763069) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol
PubChem CID22763069
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol
SMILESCC(O)(CCCn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C14H17FN2O/c1-14(18,12-3-5-13(15)6-4-12)7-2-9-17-10-8-16-11-17/h3-6,8,10-11,18H,2,7,9H2,1H3
InChIKeyLNLFWAHKOJUFBM-UHFFFAOYSA-N
XLogP2.71
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 22762962
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1-[4-(4-fluorophenoxy)butyl]imidazole
CID 31196577
2-(4-fluorophenyl)-1-imidazol-1-yl-3-methyl-3-(1,2,4-triazol-1-yl)butan-2-ol
CID 15593724
1-(4-fluorophenoxy)-N-(3-imidazol-1-ylpropyl)-2-methylpropan-2-amine
CID 18349625
1-[5-(4-fluorophenoxy)pentyl]imidazole
CID 2851826
2-(ethylamino)-5-imidazol-1-yl-2-methylpentan-1-ol
CID 64809006
2-(4-fluorophenyl)-1-imidazol-1-ylpent-4-en-2-ol
CID 12771346
1-(11,11-dimethyldodecyl)imidazole
CID 118887404
2-(4-fluorophenyl)-6-methylheptan-2-ol
CID 83158726
1-(4-fluorophenyl)-3-(imidazol-1-ylmethyl)heptan-3-ol
CID 22762885
N-[(4-fluorophenyl)methyl]-3-imidazol-1-ylpropan-1-amine;hydrochloride
CID 17155304

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol?
The IUPAC name of 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol (CID 22763069) is 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol.
What is the SMILES notation for 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol?
The canonical SMILES for 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol is CC(O)(CCCn1ccnc1)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol?
The InChIKey is LNLFWAHKOJUFBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-14(18,12-3-5-13(15)6-4-12)7-2-9-17-10-8-16-11-17/h3-6,8,10-11,18H,2,7,9H2,1H3.
What are the key properties of 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol?
2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol has a molecular weight of 248.30 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-imidazol-1-ylpentan-2-ol is sourced from PubChem (CID 22763069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).