6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid

C14H14N2O3S — CID 122054334

IUPAC6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCOC(c3ccsc3)C2)n1
InChIInChI=1S/C14H14N2O3S/c17-14(18)11-2-1-3-13(15-11)16-5-6-19-12(8-16)10-4-7-20-9-10/h1-4,7,9,12H,5-6,8H2,(H,17,18)
InChIKeyNBRWLLBBCKXJOM-UHFFFAOYSA-N
MW290.34 g/mol
LogP2.42
Rot. Bonds3

About 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid

6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid (PubChem CID 122054334) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid
PubChem CID122054334
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC Name6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCOC(c3ccsc3)C2)n1
InChIInChI=1S/C14H14N2O3S/c17-14(18)11-2-1-3-13(15-11)16-5-6-19-12(8-16)10-4-7-20-9-10/h1-4,7,9,12H,5-6,8H2,(H,17,18)
InChIKeyNBRWLLBBCKXJOM-UHFFFAOYSA-N
XLogP2.42
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid?
The IUPAC name of 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid (CID 122054334) is 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid is O=C(O)c1cccc(N2CCOC(c3ccsc3)C2)n1.
What is the InChIKey of 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid?
The InChIKey is NBRWLLBBCKXJOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c17-14(18)11-2-1-3-13(15-11)16-5-6-19-12(8-16)10-4-7-20-9-10/h1-4,7,9,12H,5-6,8H2,(H,17,18).
What are the key properties of 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid?
6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid has a molecular weight of 290.34 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 122054334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).