3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine

C11H12FN3O — CID 126954050

IUPAC3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine
SMILESCc1nc(OCc2cnn(C)c2)ccc1F
InChIInChI=1S/C11H12FN3O/c1-8-10(12)3-4-11(14-8)16-7-9-5-13-15(2)6-9/h3-6H,7H2,1-2H3
InChIKeyRHXZHMARLHLDMQ-UHFFFAOYSA-N
MW221.23 g/mol
LogP1.84
Rot. Bonds3

About 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine

3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine (PubChem CID 126954050) has the molecular formula C11H12FN3O and a molecular weight of 221.23 g/mol. Its IUPAC name is 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine.

Molecular Properties

Compound Name3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine
PubChem CID126954050
Molecular FormulaC11H12FN3O
Molecular Weight221.23 g/mol
Exact Mass221.10
IUPAC Name3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine
SMILESCc1nc(OCc2cnn(C)c2)ccc1F
InChIInChI=1S/C11H12FN3O/c1-8-10(12)3-4-11(14-8)16-7-9-5-13-15(2)6-9/h3-6H,7H2,1-2H3
InChIKeyRHXZHMARLHLDMQ-UHFFFAOYSA-N
XLogP1.84
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.23
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine?
The IUPAC name of 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine (CID 126954050) is 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine.
What is the SMILES notation for 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine?
The canonical SMILES for 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine is Cc1nc(OCc2cnn(C)c2)ccc1F.
What is the InChIKey of 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine?
The InChIKey is RHXZHMARLHLDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12FN3O/c1-8-10(12)3-4-11(14-8)16-7-9-5-13-15(2)6-9/h3-6H,7H2,1-2H3.
What are the key properties of 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine?
3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine has a molecular weight of 221.23 g/mol, XLogP of 1.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-methyl-6-[(1-methylpyrazol-4-yl)methoxy]pyridine is sourced from PubChem (CID 126954050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).