6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid

C16H16N2O4 — CID 122054423

IUPAC6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCOC(c3cccc(O)c3)C2)n1
InChIInChI=1S/C16H16N2O4/c19-12-4-1-3-11(9-12)14-10-18(7-8-22-14)15-6-2-5-13(17-15)16(20)21/h1-6,9,14,19H,7-8,10H2,(H,20,21)
InChIKeyHNNJVBNSILGCAX-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.06
Rot. Bonds3

About 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid

6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid (PubChem CID 122054423) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid
PubChem CID122054423
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC Name6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCOC(c3cccc(O)c3)C2)n1
InChIInChI=1S/C16H16N2O4/c19-12-4-1-3-11(9-12)14-10-18(7-8-22-14)15-6-2-5-13(17-15)16(20)21/h1-6,9,14,19H,7-8,10H2,(H,20,21)
InChIKeyHNNJVBNSILGCAX-UHFFFAOYSA-N
XLogP2.06
TPSA82.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2-thiophen-3-ylmorpholin-4-yl)pyridine-2-carboxylic acid
CID 122054334
6-[2-(1,3-thiazol-2-yl)morpholin-4-yl]pyridine-2-carboxylic acid
CID 122053464
6-(2-cyanomorpholin-4-yl)pyridine-2-carboxylic acid
CID 79681061
3-[(2R)-4-(5-fluoropyrimidin-2-yl)morpholin-2-yl]phenol
CID 97069431
6-(2-cyclohexylmorpholin-4-yl)pyridine-2-carboxylic acid
CID 122051271
3-[(2R)-4-(3-fluoro-2-pyridinyl)morpholin-2-yl]phenol
CID 97069433
6-[3-(oxan-4-yl)pyrrolidin-1-yl]pyridine-2-carboxylic acid
CID 122054567
3-[(2R)-4-(6-methyl-3-nitro-2-pyridinyl)morpholin-2-yl]phenol
CID 97069419
3-[4-(3-ethyl-2-methylquinolin-4-yl)morpholin-2-yl]phenol
CID 133438456
6-(3-hydroxyazetidin-1-yl)pyridine-2-carboxylic acid
CID 83830615
6-(3-fluoropyrrolidin-1-yl)pyridine-2-carboxylic acid
CID 122057812
(2,4-dimethyl-1,3-oxazol-5-yl)-[(2S)-2-(3-hydroxyphenyl)morpholin-4-yl]methanone
CID 97066824

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The IUPAC name of 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid (CID 122054423) is 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid is O=C(O)c1cccc(N2CCOC(c3cccc(O)c3)C2)n1.
What is the InChIKey of 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The InChIKey is HNNJVBNSILGCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c19-12-4-1-3-11(9-12)14-10-18(7-8-22-14)15-6-2-5-13(17-15)16(20)21/h1-6,9,14,19H,7-8,10H2,(H,20,21).
What are the key properties of 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid has a molecular weight of 300.31 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-hydroxyphenyl)morpholin-4-yl]pyridine-2-carboxylic acid is sourced from PubChem (CID 122054423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).