6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid

C16H15ClN2O3 — CID 122057768

IUPAC6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCO[C@H](c3ccc(Cl)cc3)C2)n1
InChIInChI=1S/C16H15ClN2O3/c17-12-6-4-11(5-7-12)14-10-19(8-9-22-14)15-3-1-2-13(18-15)16(20)21/h1-7,14H,8-10H2,(H,20,21)/t14-/m0/s1
InChIKeyJNJLYLQRLSSFNJ-AWEZNQCLSA-N
MW318.76 g/mol
LogP3.01
Rot. Bonds3

About 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid

6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid (PubChem CID 122057768) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid
PubChem CID122057768
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(N2CCO[C@H](c3ccc(Cl)cc3)C2)n1
InChIInChI=1S/C16H15ClN2O3/c17-12-6-4-11(5-7-12)14-10-19(8-9-22-14)15-3-1-2-13(18-15)16(20)21/h1-7,14H,8-10H2,(H,20,21)/t14-/m0/s1
InChIKeyJNJLYLQRLSSFNJ-AWEZNQCLSA-N
XLogP3.01
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The IUPAC name of 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid (CID 122057768) is 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid.
What is the SMILES notation for 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The canonical SMILES for 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid is O=C(O)c1cccc(N2CCO[C@H](c3ccc(Cl)cc3)C2)n1.
What is the InChIKey of 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
The InChIKey is JNJLYLQRLSSFNJ-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c17-12-6-4-11(5-7-12)14-10-19(8-9-22-14)15-3-1-2-13(18-15)16(20)21/h1-7,14H,8-10H2,(H,20,21)/t14-/m0/s1.
What are the key properties of 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid?
6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid has a molecular weight of 318.76 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]pyridine-2-carboxylic acid is sourced from PubChem (CID 122057768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).