[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol

C10H11FN2O — CID 134536086

IUPAC[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol
SMILESOCc1cn(C2=CCCC=C2F)cn1
InChIInChI=1S/C10H11FN2O/c11-9-3-1-2-4-10(9)13-5-8(6-14)12-7-13/h3-5,7,14H,1-2,6H2
InChIKeyGOWNXDDKJHAXLI-UHFFFAOYSA-N
MW194.21 g/mol
LogP1.86
Rot. Bonds2

About [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol

[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol (PubChem CID 134536086) has the molecular formula C10H11FN2O and a molecular weight of 194.21 g/mol. Its IUPAC name is [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol
PubChem CID134536086
Molecular FormulaC10H11FN2O
Molecular Weight194.21 g/mol
Exact Mass194.09
IUPAC Name[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol
SMILESOCc1cn(C2=CCCC=C2F)cn1
InChIInChI=1S/C10H11FN2O/c11-9-3-1-2-4-10(9)13-5-8(6-14)12-7-13/h3-5,7,14H,1-2,6H2
InChIKeyGOWNXDDKJHAXLI-UHFFFAOYSA-N
XLogP1.86
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol?
The IUPAC name of [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol (CID 134536086) is [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol.
What is the SMILES notation for [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol?
The canonical SMILES for [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol is OCc1cn(C2=CCCC=C2F)cn1.
What is the InChIKey of [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol?
The InChIKey is GOWNXDDKJHAXLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2O/c11-9-3-1-2-4-10(9)13-5-8(6-14)12-7-13/h3-5,7,14H,1-2,6H2.
What are the key properties of [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol?
[1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol has a molecular weight of 194.21 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-fluorocyclohexa-1,5-dien-1-yl)imidazol-4-yl]methanol is sourced from PubChem (CID 134536086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).