5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid

C14H12FNO3 — CID 105371812

IUPAC5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid
SMILESCc1ccc(F)cc1COc1ccc(C(=O)O)nc1
InChIInChI=1S/C14H12FNO3/c1-9-2-3-11(15)6-10(9)8-19-12-4-5-13(14(17)18)16-7-12/h2-7H,8H2,1H3,(H,17,18)
InChIKeyVDQBAXHUONFLHC-UHFFFAOYSA-N
MW261.25 g/mol
LogP2.81
Rot. Bonds4

About 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid

5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid (PubChem CID 105371812) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid
PubChem CID105371812
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC Name5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid
SMILESCc1ccc(F)cc1COc1ccc(C(=O)O)nc1
InChIInChI=1S/C14H12FNO3/c1-9-2-3-11(15)6-10(9)8-19-12-4-5-13(14(17)18)16-7-12/h2-7H,8H2,1H3,(H,17,18)
InChIKeyVDQBAXHUONFLHC-UHFFFAOYSA-N
XLogP2.81
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-bromo-4-fluorophenyl)methoxy]pyridine-2-carboxylic acid
CID 79793811
2-fluoro-4-[(5-fluoro-2-methylphenyl)methoxy]benzoic acid
CID 107675308
4-fluoro-2-[(6-methyl-3-pyridinyl)oxymethyl]benzoic acid
CID 104637795
1-[4-[(5-fluoro-2-methylphenyl)methoxy]phenyl]ethanone
CID 105371730
1-[5-[(5-fluoro-2-methylphenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 105370370
5-fluoro-2-[(6-methyl-3-pyridinyl)oxymethyl]benzoic acid
CID 55173092
4-[4-[(5-fluoro-2-methylphenyl)methoxy]phenyl]butan-2-one
CID 105371732
5-[(2-bromo-5-methoxyphenyl)methoxy]pyridine-2-carboxylic acid
CID 79794336
5-[(5-methyl-3-pyridinyl)methoxy]pyridine-2-carboxylic acid
CID 102881330
5-[(5-fluoro-2-methylphenyl)methoxy]-2-methylaniline
CID 114252463
1-[4-fluoro-2-[(5-fluoro-2-methylphenyl)methoxy]phenyl]ethanone
CID 105371740
4-fluoro-2-[(4-fluoro-3-methylphenoxy)methyl]benzoic acid
CID 104637832

Frequently Asked Questions

What is the IUPAC name of 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid?
The IUPAC name of 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid (CID 105371812) is 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid.
What is the SMILES notation for 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid?
The canonical SMILES for 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid is Cc1ccc(F)cc1COc1ccc(C(=O)O)nc1.
What is the InChIKey of 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid?
The InChIKey is VDQBAXHUONFLHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-9-2-3-11(15)6-10(9)8-19-12-4-5-13(14(17)18)16-7-12/h2-7H,8H2,1H3,(H,17,18).
What are the key properties of 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid?
5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid has a molecular weight of 261.25 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-fluoro-2-methylphenyl)methoxy]pyridine-2-carboxylic acid is sourced from PubChem (CID 105371812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).