5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid

C14H11FN2O4 — CID 63851699

IUPAC5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid
SMILESNC(=O)c1ccc(F)c(COc2cncc(C(=O)O)c2)c1
InChIInChI=1S/C14H11FN2O4/c15-12-2-1-8(13(16)18)3-10(12)7-21-11-4-9(14(19)20)5-17-6-11/h1-6H,7H2,(H2,16,18)(H,19,20)
InChIKeyYOOKCYSQBHYZLY-UHFFFAOYSA-N
MW290.25 g/mol
LogP1.60
Rot. Bonds5

About 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid

5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid (PubChem CID 63851699) has the molecular formula C14H11FN2O4 and a molecular weight of 290.25 g/mol. Its IUPAC name is 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid
PubChem CID63851699
Molecular FormulaC14H11FN2O4
Molecular Weight290.25 g/mol
Exact Mass290.07
IUPAC Name5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid
SMILESNC(=O)c1ccc(F)c(COc2cncc(C(=O)O)c2)c1
InChIInChI=1S/C14H11FN2O4/c15-12-2-1-8(13(16)18)3-10(12)7-21-11-4-9(14(19)20)5-17-6-11/h1-6H,7H2,(H2,16,18)(H,19,20)
InChIKeyYOOKCYSQBHYZLY-UHFFFAOYSA-N
XLogP1.60
TPSA102.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.25
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-fluorophenyl)methoxy]pyridine-3-carboxylic acid
CID 63852379
4-fluoro-3-(pyridin-3-yloxymethyl)benzoic acid
CID 63074970
4-fluoro-3-[(4-hydroxyphenoxy)methyl]benzamide
CID 43326289
3-[(4-chlorophenoxy)methyl]-4-fluorobenzamide
CID 64763801
3-[(3,5-dimethylphenoxy)methyl]-4-fluorobenzamide
CID 65202032
5-[(2-bromo-4-fluorophenyl)methoxy]pyridine-3-carboxylic acid
CID 63850652
3-[(3,5-difluorophenoxy)methyl]-4-fluorobenzoic acid
CID 63073644
4-[(5-chloro-2-fluorophenyl)methoxy]benzoic acid
CID 103046268
4-fluoro-3-(hydroxymethyl)benzamide
CID 43558815
4-fluoro-3-[(2-hydroxyphenoxy)methyl]benzamide
CID 43143477
3-[(4-bromo-3-fluorophenoxy)methyl]-4-fluorobenzoic acid
CID 65202713
5-[3-(4-chlorophenoxy)propoxy]pyridine-3-carboxylic acid
CID 63852389

Frequently Asked Questions

What is the IUPAC name of 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid?
The IUPAC name of 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid (CID 63851699) is 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid.
What is the SMILES notation for 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid?
The canonical SMILES for 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid is NC(=O)c1ccc(F)c(COc2cncc(C(=O)O)c2)c1.
What is the InChIKey of 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid?
The InChIKey is YOOKCYSQBHYZLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O4/c15-12-2-1-8(13(16)18)3-10(12)7-21-11-4-9(14(19)20)5-17-6-11/h1-6H,7H2,(H2,16,18)(H,19,20).
What are the key properties of 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid?
5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid has a molecular weight of 290.25 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(5-carbamoyl-2-fluorophenyl)methoxy]pyridine-3-carboxylic acid is sourced from PubChem (CID 63851699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).