[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol

C12H12F2N2O2 — CID 43326932

IUPAC[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol
SMILESOCc1cccc(OCc2nccn2C(F)F)c1
InChIInChI=1S/C12H12F2N2O2/c13-12(14)16-5-4-15-11(16)8-18-10-3-1-2-9(6-10)7-17/h1-6,12,17H,7-8H2
InChIKeyUFAHVPOIRWKQPR-UHFFFAOYSA-N
MW254.24 g/mol
LogP2.35
Rot. Bonds5

About [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol

[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol (PubChem CID 43326932) has the molecular formula C12H12F2N2O2 and a molecular weight of 254.24 g/mol. Its IUPAC name is [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol
PubChem CID43326932
Molecular FormulaC12H12F2N2O2
Molecular Weight254.24 g/mol
Exact Mass254.09
IUPAC Name[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol
SMILESOCc1cccc(OCc2nccn2C(F)F)c1
InChIInChI=1S/C12H12F2N2O2/c13-12(14)16-5-4-15-11(16)8-18-10-3-1-2-9(6-10)7-17/h1-6,12,17H,7-8H2
InChIKeyUFAHVPOIRWKQPR-UHFFFAOYSA-N
XLogP2.35
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]ethanamine
CID 55191156
1-(difluoromethyl)-2-[(4-fluoro-3-methylphenoxy)methyl]imidazole
CID 81421392
1-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]propan-2-amine
CID 115494550
1-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]propan-2-one
CID 115495324
[2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-5-methoxyphenyl]methanol
CID 43267887
[3-(fluoromethoxy)phenyl]methanol
CID 130445893
5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2,3-dihydro-1H-inden-1-amine
CID 107683199
[3-[[4-(difluoromethoxy)phenyl]methoxy]phenyl]methanol
CID 111770249
[3-(oxiren-2-ylmethoxy)phenyl]methanol
CID 163982140
2-[(4-butan-2-ylphenoxy)methyl]-1-(difluoromethyl)imidazole
CID 103606232
4-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]butan-2-amine
CID 60879959
[3-[(1-methylpyrazol-3-yl)methoxy]phenyl]methanol
CID 82866640

Frequently Asked Questions

What is the IUPAC name of [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol?
The IUPAC name of [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol (CID 43326932) is [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol.
What is the SMILES notation for [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol?
The canonical SMILES for [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol is OCc1cccc(OCc2nccn2C(F)F)c1.
What is the InChIKey of [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol?
The InChIKey is UFAHVPOIRWKQPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F2N2O2/c13-12(14)16-5-4-15-11(16)8-18-10-3-1-2-9(6-10)7-17/h1-6,12,17H,7-8H2.
What are the key properties of [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol?
[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol has a molecular weight of 254.24 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol is sourced from PubChem (CID 43326932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).