3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid

C8H8ClNO4 — CID 107063382

IUPAC3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid
SMILESO=C(O)c1ccnc(OCCO)c1Cl
InChIInChI=1S/C8H8ClNO4/c9-6-5(8(12)13)1-2-10-7(6)14-4-3-11/h1-2,11H,3-4H2,(H,12,13)
InChIKeyHGXLQMPXKISOJU-UHFFFAOYSA-N
MW217.61 g/mol
LogP0.80
Rot. Bonds4

About 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid

3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid (PubChem CID 107063382) has the molecular formula C8H8ClNO4 and a molecular weight of 217.61 g/mol. Its IUPAC name is 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid
PubChem CID107063382
Molecular FormulaC8H8ClNO4
Molecular Weight217.61 g/mol
Exact Mass217.01
IUPAC Name3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid
SMILESO=C(O)c1ccnc(OCCO)c1Cl
InChIInChI=1S/C8H8ClNO4/c9-6-5(8(12)13)1-2-10-7(6)14-4-3-11/h1-2,11H,3-4H2,(H,12,13)
InChIKeyHGXLQMPXKISOJU-UHFFFAOYSA-N
XLogP0.80
TPSA79.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.61
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-chloro-2-(2-pyridin-2-ylethoxy)pyridine-4-carboxylic acid
CID 107063375
3-chloro-2-[2-(2-hydroxyethyl)phenoxy]pyridine-4-carboxylic acid
CID 107714129
3-chloro-2-(4-propoxyphenoxy)pyridine-4-carboxylic acid
CID 107063396
3-chloro-2-(2-hydroxyethoxy)pyridine-4-carbonitrile
CID 107058885
3-chloro-N'-hydroxy-2-(3-hydroxypropoxy)pyridine-4-carboximidamide
CID 136739694
3-chloropyridine-2,4-dicarboxylic acid
CID 134247663
3-amino-2-(2-cyclopropylethoxy)pyridine-4-carboxylic acid
CID 106203425
2-(2-bromophenoxy)-3-chloropyridine-4-carboxylic acid
CID 107063355
3-chloro-2-(2,5-dichlorophenoxy)pyridine-4-carboxylic acid
CID 107063256
lithium;2,3-dichloropyridine-4-carboxylic acid;hydride
CID 174387872
2-(5-bromo-2-chlorophenoxy)-3-chloropyridine-4-carboxylic acid
CID 107063534
2,3-bis(2-hydroxyethoxy)terephthalic acid
CID 18003835

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid?
The IUPAC name of 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid (CID 107063382) is 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid.
What is the SMILES notation for 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid?
The canonical SMILES for 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid is O=C(O)c1ccnc(OCCO)c1Cl.
What is the InChIKey of 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid?
The InChIKey is HGXLQMPXKISOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNO4/c9-6-5(8(12)13)1-2-10-7(6)14-4-3-11/h1-2,11H,3-4H2,(H,12,13).
What are the key properties of 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid?
3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid has a molecular weight of 217.61 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2-hydroxyethoxy)pyridine-4-carboxylic acid is sourced from PubChem (CID 107063382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).