[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine

C11H12F2N4O — CID 79788216

IUPAC[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine
SMILESNCc1ccc(OCc2nccn2C(F)F)cn1
InChIInChI=1S/C11H12F2N4O/c12-11(13)17-4-3-15-10(17)7-18-9-2-1-8(5-14)16-6-9/h1-4,6,11H,5,7,14H2
InChIKeyGBMWASAWCOFVGL-UHFFFAOYSA-N
MW254.24 g/mol
LogP1.71
Rot. Bonds5

About [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine

[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine (PubChem CID 79788216) has the molecular formula C11H12F2N4O and a molecular weight of 254.24 g/mol. Its IUPAC name is [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine
PubChem CID79788216
Molecular FormulaC11H12F2N4O
Molecular Weight254.24 g/mol
Exact Mass254.10
IUPAC Name[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine
SMILESNCc1ccc(OCc2nccn2C(F)F)cn1
InChIInChI=1S/C11H12F2N4O/c12-11(13)17-4-3-15-10(17)7-18-9-2-1-8(5-14)16-6-9/h1-4,6,11H,5,7,14H2
InChIKeyGBMWASAWCOFVGL-UHFFFAOYSA-N
XLogP1.71
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.24
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]benzaldehyde
CID 43112135
1-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]propan-2-amine
CID 115494550
2-[(4-butan-2-ylphenoxy)methyl]-1-(difluoromethyl)imidazole
CID 103606232
1-(difluoromethyl)-2-[(4-fluoro-3-methylphenoxy)methyl]imidazole
CID 81421392
4-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]butan-2-amine
CID 60879959
4-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]-1,3-thiazole
CID 75424823
[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-3-fluorophenyl]methanamine
CID 107686258
1-[4-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]propan-2-one
CID 115495324
1-(difluoromethyl)-2-(methoxymethyl)imidazole
CID 156846999
[2-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-3-ethoxyphenyl]methanamine
CID 60878707
[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]methanol
CID 43326932
(1S)-1-[3-[[1-(difluoromethyl)imidazol-2-yl]methoxy]phenyl]ethanamine
CID 55191156

Frequently Asked Questions

What is the IUPAC name of [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine?
The IUPAC name of [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine (CID 79788216) is [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine.
What is the SMILES notation for [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine?
The canonical SMILES for [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine is NCc1ccc(OCc2nccn2C(F)F)cn1.
What is the InChIKey of [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine?
The InChIKey is GBMWASAWCOFVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2N4O/c12-11(13)17-4-3-15-10(17)7-18-9-2-1-8(5-14)16-6-9/h1-4,6,11H,5,7,14H2.
What are the key properties of [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine?
[5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine has a molecular weight of 254.24 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[[1-(difluoromethyl)imidazol-2-yl]methoxy]-2-pyridinyl]methanamine is sourced from PubChem (CID 79788216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).