[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol

C11H10F2N2O2 — CID 67031790

IUPAC[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1nc(-c2cccc(F)c2F)[nH]c1CO
InChIInChI=1S/C11H10F2N2O2/c12-7-3-1-2-6(10(7)13)11-14-8(4-16)9(5-17)15-11/h1-3,16-17H,4-5H2,(H,14,15)
InChIKeyZAUJXPULVPHBSW-UHFFFAOYSA-N
MW240.21 g/mol
LogP1.34
Rot. Bonds3

About [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol

[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol (PubChem CID 67031790) has the molecular formula C11H10F2N2O2 and a molecular weight of 240.21 g/mol. Its IUPAC name is [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol
PubChem CID67031790
Molecular FormulaC11H10F2N2O2
Molecular Weight240.21 g/mol
Exact Mass240.07
IUPAC Name[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol
SMILESOCc1nc(-c2cccc(F)c2F)[nH]c1CO
InChIInChI=1S/C11H10F2N2O2/c12-7-3-1-2-6(10(7)13)11-14-8(4-16)9(5-17)15-11/h1-3,16-17H,4-5H2,(H,14,15)
InChIKeyZAUJXPULVPHBSW-UHFFFAOYSA-N
XLogP1.34
TPSA69.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol?
The IUPAC name of [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol (CID 67031790) is [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol.
What is the SMILES notation for [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol?
The canonical SMILES for [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol is OCc1nc(-c2cccc(F)c2F)[nH]c1CO.
What is the InChIKey of [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol?
The InChIKey is ZAUJXPULVPHBSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2O2/c12-7-3-1-2-6(10(7)13)11-14-8(4-16)9(5-17)15-11/h1-3,16-17H,4-5H2,(H,14,15).
What are the key properties of [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol?
[2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol has a molecular weight of 240.21 g/mol, XLogP of 1.34, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-difluorophenyl)-4-(hydroxymethyl)-1H-imidazol-5-yl]methanol is sourced from PubChem (CID 67031790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).