3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid

C15H14FNO4 — CID 105379997

IUPAC3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid
SMILESCOCCc1ccc(Oc2nccc(C(=O)O)c2F)cc1
InChIInChI=1S/C15H14FNO4/c1-20-9-7-10-2-4-11(5-3-10)21-14-13(16)12(15(18)19)6-8-17-14/h2-6,8H,7,9H2,1H3,(H,18,19)
InChIKeyRVWZMSIDIGJGLR-UHFFFAOYSA-N
MW291.28 g/mol
LogP2.90
Rot. Bonds6

About 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid

3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid (PubChem CID 105379997) has the molecular formula C15H14FNO4 and a molecular weight of 291.28 g/mol. Its IUPAC name is 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid
PubChem CID105379997
Molecular FormulaC15H14FNO4
Molecular Weight291.28 g/mol
Exact Mass291.09
IUPAC Name3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid
SMILESCOCCc1ccc(Oc2nccc(C(=O)O)c2F)cc1
InChIInChI=1S/C15H14FNO4/c1-20-9-7-10-2-4-11(5-3-10)21-14-13(16)12(15(18)19)6-8-17-14/h2-6,8H,7,9H2,1H3,(H,18,19)
InChIKeyRVWZMSIDIGJGLR-UHFFFAOYSA-N
XLogP2.90
TPSA68.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.28
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(chloromethyl)-3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine
CID 105383838
3-fluoro-2-(3-methoxyphenoxy)pyridine-4-carboxylic acid
CID 105379912
5-amino-6-[4-(2-methoxyethyl)phenoxy]pyridine-3-carboxylic acid
CID 81447219
2-[4-(2-methoxyethyl)phenoxy]pyridin-3-amine
CID 43352037
3-fluoro-2-(1-propan-2-ylpyrazol-4-yl)oxypyridine-4-carboxylic acid
CID 105380111
3-fluoro-2-[2-methoxyethyl(propan-2-yl)amino]pyridine-4-carboxylic acid
CID 105382575
3-fluoro-2-prop-2-enoxypyridine-4-carboxylic acid
CID 105379985
3-chloro-2-(4-propoxyphenoxy)pyridine-4-carboxylic acid
CID 107063396
3-[4-(2-methoxyethyl)phenoxy]-2-methylpropanoic acid
CID 43538057
1-(2-ethoxy-3-fluoro-4-pyridinyl)-3-(2-methoxyethoxy)propan-1-one
CID 114270335
2-bromo-6-[4-(2-methoxyethyl)phenoxy]benzoic acid
CID 114888627
1-[5-fluoro-2-[4-(2-methoxyethyl)phenoxy]phenyl]ethanone
CID 43244939

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid?
The IUPAC name of 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid (CID 105379997) is 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid.
What is the SMILES notation for 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid?
The canonical SMILES for 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid is COCCc1ccc(Oc2nccc(C(=O)O)c2F)cc1.
What is the InChIKey of 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid?
The InChIKey is RVWZMSIDIGJGLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO4/c1-20-9-7-10-2-4-11(5-3-10)21-14-13(16)12(15(18)19)6-8-17-14/h2-6,8H,7,9H2,1H3,(H,18,19).
What are the key properties of 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid?
3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid has a molecular weight of 291.28 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-[4-(2-methoxyethyl)phenoxy]pyridine-4-carboxylic acid is sourced from PubChem (CID 105379997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).