2-(fluoromethyl)-1H-imidazol-5-ol

C4H5FN2O — CID 84762079

IUPAC2-(fluoromethyl)-1H-imidazol-5-ol
SMILESOc1cnc(CF)[nH]1
InChIInChI=1S/C4H5FN2O/c5-1-3-6-2-4(8)7-3/h2,8H,1H2,(H,6,7)
InChIKeyUOPPBWOJIQRITD-UHFFFAOYSA-N
MW116.09 g/mol
LogP0.58
Rot. Bonds1

About 2-(fluoromethyl)-1H-imidazol-5-ol

2-(fluoromethyl)-1H-imidazol-5-ol (PubChem CID 84762079) has the molecular formula C4H5FN2O and a molecular weight of 116.09 g/mol. Its IUPAC name is 2-(fluoromethyl)-1H-imidazol-5-ol.

Molecular Properties

Compound Name2-(fluoromethyl)-1H-imidazol-5-ol
PubChem CID84762079
Molecular FormulaC4H5FN2O
Molecular Weight116.09 g/mol
Exact Mass116.04
IUPAC Name2-(fluoromethyl)-1H-imidazol-5-ol
SMILESOc1cnc(CF)[nH]1
InChIInChI=1S/C4H5FN2O/c5-1-3-6-2-4(8)7-3/h2,8H,1H2,(H,6,7)
InChIKeyUOPPBWOJIQRITD-UHFFFAOYSA-N
XLogP0.58
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.09
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-1H-imidazol-5-ol?
The IUPAC name of 2-(fluoromethyl)-1H-imidazol-5-ol (CID 84762079) is 2-(fluoromethyl)-1H-imidazol-5-ol.
What is the SMILES notation for 2-(fluoromethyl)-1H-imidazol-5-ol?
The canonical SMILES for 2-(fluoromethyl)-1H-imidazol-5-ol is Oc1cnc(CF)[nH]1.
What is the InChIKey of 2-(fluoromethyl)-1H-imidazol-5-ol?
The InChIKey is UOPPBWOJIQRITD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5FN2O/c5-1-3-6-2-4(8)7-3/h2,8H,1H2,(H,6,7).
What are the key properties of 2-(fluoromethyl)-1H-imidazol-5-ol?
2-(fluoromethyl)-1H-imidazol-5-ol has a molecular weight of 116.09 g/mol, XLogP of 0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-1H-imidazol-5-ol is sourced from PubChem (CID 84762079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).