6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine

C16H13F2N3O — CID 171682304

IUPAC6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine
SMILESCOc1nc(-c2cc(F)cc(F)c2)ccc1-n1cnc(C)c1
InChIInChI=1S/C16H13F2N3O/c1-10-8-21(9-19-10)15-4-3-14(20-16(15)22-2)11-5-12(17)7-13(18)6-11/h3-9H,1-2H3
InChIKeyZMRGIAFAGYVVLU-UHFFFAOYSA-N
MW301.30 g/mol
LogP3.53
Rot. Bonds3

About 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine

6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine (PubChem CID 171682304) has the molecular formula C16H13F2N3O and a molecular weight of 301.30 g/mol. Its IUPAC name is 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine.

Molecular Properties

Compound Name6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine
PubChem CID171682304
Molecular FormulaC16H13F2N3O
Molecular Weight301.30 g/mol
Exact Mass301.10
IUPAC Name6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine
SMILESCOc1nc(-c2cc(F)cc(F)c2)ccc1-n1cnc(C)c1
InChIInChI=1S/C16H13F2N3O/c1-10-8-21(9-19-10)15-4-3-14(20-16(15)22-2)11-5-12(17)7-13(18)6-11/h3-9H,1-2H3
InChIKeyZMRGIAFAGYVVLU-UHFFFAOYSA-N
XLogP3.53
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethyl-N-[(4-fluorophenyl)methyl]-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]pyridazin-3-amine
CID 134391551
N-[1-(4-fluorophenyl)-2-methoxyethyl]-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methylpyridazin-3-amine
CID 140855855
4-ethyl-N-[1-(4-fluorophenyl)ethyl]-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]pyridazin-3-amine
CID 121305905
8-(4-fluorophenyl)-2-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-7-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 67606635
3-[(2R)-2,3-dimethylbutyl]-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methylpyridazine;2-methylpropane
CID 162065678
6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methyl-N-[1-(3,4,5-trifluorophenyl)ethyl]pyridazin-3-amine
CID 175029624
5-ethyl-N-[1-(4-fluorophenyl)ethyl]-3-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]pyridazin-4-amine
CID 121305893
6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methyl-N-[(2S)-4,4,4-trifluoro-2-(4-fluorophenyl)butan-2-yl]pyridazin-3-amine
CID 162614026
N-[(2R)-butan-2-yl]-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methylpyridazin-3-amine
CID 134391564
N-cyclohexyl-6-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-4-methylpyridazin-3-amine
CID 134391643
6-[5-[(2,5-dimethylphenyl)methyl]-1H-1,2,4-triazol-3-yl]-2-methoxy-3-(4-methylimidazol-1-yl)pyridine
CID 91136433
2-(4-fluorophenyl)-N-[6-methoxy-5-(4-methylimidazol-1-yl)-2-pyridinyl]-1-methylbenzimidazol-4-amine
CID 46861576

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine?
The IUPAC name of 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine (CID 171682304) is 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine.
What is the SMILES notation for 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine?
The canonical SMILES for 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine is COc1nc(-c2cc(F)cc(F)c2)ccc1-n1cnc(C)c1.
What is the InChIKey of 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine?
The InChIKey is ZMRGIAFAGYVVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13F2N3O/c1-10-8-21(9-19-10)15-4-3-14(20-16(15)22-2)11-5-12(17)7-13(18)6-11/h3-9H,1-2H3.
What are the key properties of 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine?
6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine has a molecular weight of 301.30 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-difluorophenyl)-2-methoxy-3-(4-methylimidazol-1-yl)pyridine is sourced from PubChem (CID 171682304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).