4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid

C14H10N2O4 — CID 43325992

IUPAC4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid
SMILESCOc1cc(C#N)ccc1Oc1ccnc(C(=O)O)c1
InChIInChI=1S/C14H10N2O4/c1-19-13-6-9(8-15)2-3-12(13)20-10-4-5-16-11(7-10)14(17)18/h2-7H,1H3,(H,17,18)
InChIKeyWVAHQGCNMDHEOI-UHFFFAOYSA-N
MW270.24 g/mol
LogP2.45
Rot. Bonds4

About 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid

4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid (PubChem CID 43325992) has the molecular formula C14H10N2O4 and a molecular weight of 270.24 g/mol. Its IUPAC name is 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid
PubChem CID43325992
Molecular FormulaC14H10N2O4
Molecular Weight270.24 g/mol
Exact Mass270.06
IUPAC Name4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid
SMILESCOc1cc(C#N)ccc1Oc1ccnc(C(=O)O)c1
InChIInChI=1S/C14H10N2O4/c1-19-13-6-9(8-15)2-3-12(13)20-10-4-5-16-11(7-10)14(17)18/h2-7H,1H3,(H,17,18)
InChIKeyWVAHQGCNMDHEOI-UHFFFAOYSA-N
XLogP2.45
TPSA92.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.24
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(4-cyanophenoxy)pyridine-2-carboxylic acid
CID 43142929
4-(4-cyano-2-methoxyphenoxy)-2-methylbenzoic acid
CID 62134443
6-(4-cyano-2-methoxyphenoxy)pyridine-3-carboxylic acid
CID 16792097
5-(4-cyano-2-methoxyphenoxy)pyridine-2-carbonitrile
CID 115487862
2-amino-5-(4-cyano-2-methoxyphenoxy)benzamide
CID 61313483
4-(2-ethoxyphenoxy)pyridine-2-carboxylic acid
CID 43142917
4-(3,4-dimethoxyphenyl)pyridine-2-carboxylic acid
CID 53223762
4-(2,4-difluorophenoxy)pyridine-2-carboxylic acid
CID 43325985
4-[4-(1-hydroxyethyl)phenoxy]-3-methoxybenzonitrile
CID 43506373
(4-cyano-2-methoxyphenyl) 2-phenoxyacetate
CID 2715586
5-amino-6-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxamide
CID 114408412
2-(4-cyano-2-methoxyphenoxy)pyridine-3-sulfonamide
CID 115928413

Frequently Asked Questions

What is the IUPAC name of 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid?
The IUPAC name of 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid (CID 43325992) is 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid?
The canonical SMILES for 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid is COc1cc(C#N)ccc1Oc1ccnc(C(=O)O)c1.
What is the InChIKey of 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid?
The InChIKey is WVAHQGCNMDHEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O4/c1-19-13-6-9(8-15)2-3-12(13)20-10-4-5-16-11(7-10)14(17)18/h2-7H,1H3,(H,17,18).
What are the key properties of 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid?
4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid has a molecular weight of 270.24 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-cyano-2-methoxyphenoxy)pyridine-2-carboxylic acid is sourced from PubChem (CID 43325992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).