5-morpholin-4-ylpyridine-3-carboxylic acid

C10H12N2O3 — CID 4738577

IUPAC5-morpholin-4-ylpyridine-3-carboxylic acid
SMILESO=C(O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C10H12N2O3/c13-10(14)8-5-9(7-11-6-8)12-1-3-15-4-2-12/h5-7H,1-4H2,(H,13,14)
InChIKeyYJEVNITWKNWUKX-UHFFFAOYSA-N
MW208.22 g/mol
LogP0.62
Rot. Bonds2

About 5-morpholin-4-ylpyridine-3-carboxylic acid

5-morpholin-4-ylpyridine-3-carboxylic acid (PubChem CID 4738577) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is 5-morpholin-4-ylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-morpholin-4-ylpyridine-3-carboxylic acid
PubChem CID4738577
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name5-morpholin-4-ylpyridine-3-carboxylic acid
SMILESO=C(O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C10H12N2O3/c13-10(14)8-5-9(7-11-6-8)12-1-3-15-4-2-12/h5-7H,1-4H2,(H,13,14)
InChIKeyYJEVNITWKNWUKX-UHFFFAOYSA-N
XLogP0.62
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-ylpyridine-3-carboxylic acid?
The IUPAC name of 5-morpholin-4-ylpyridine-3-carboxylic acid (CID 4738577) is 5-morpholin-4-ylpyridine-3-carboxylic acid.
What is the SMILES notation for 5-morpholin-4-ylpyridine-3-carboxylic acid?
The canonical SMILES for 5-morpholin-4-ylpyridine-3-carboxylic acid is O=C(O)c1cncc(N2CCOCC2)c1.
What is the InChIKey of 5-morpholin-4-ylpyridine-3-carboxylic acid?
The InChIKey is YJEVNITWKNWUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-10(14)8-5-9(7-11-6-8)12-1-3-15-4-2-12/h5-7H,1-4H2,(H,13,14).
What are the key properties of 5-morpholin-4-ylpyridine-3-carboxylic acid?
5-morpholin-4-ylpyridine-3-carboxylic acid has a molecular weight of 208.22 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-ylpyridine-3-carboxylic acid is sourced from PubChem (CID 4738577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).