(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one

C9H9ClN2O2 — CID 130658822

IUPAC(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one
SMILESO=C1COC[C@@H](c2ncccc2Cl)N1
InChIInChI=1S/C9H9ClN2O2/c10-6-2-1-3-11-9(6)7-4-14-5-8(13)12-7/h1-3,7H,4-5H2,(H,12,13)/t7-/m0/s1
InChIKeyOUBCOOZBIFLKKU-ZETCQYMHSA-N
MW212.64 g/mol
LogP0.92
Rot. Bonds1

About (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one

(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one (PubChem CID 130658822) has the molecular formula C9H9ClN2O2 and a molecular weight of 212.64 g/mol. Its IUPAC name is (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one.

Molecular Properties

Compound Name(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one
PubChem CID130658822
Molecular FormulaC9H9ClN2O2
Molecular Weight212.64 g/mol
Exact Mass212.04
IUPAC Name(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one
SMILESO=C1COC[C@@H](c2ncccc2Cl)N1
InChIInChI=1S/C9H9ClN2O2/c10-6-2-1-3-11-9(6)7-4-14-5-8(13)12-7/h1-3,7H,4-5H2,(H,12,13)/t7-/m0/s1
InChIKeyOUBCOOZBIFLKKU-ZETCQYMHSA-N
XLogP0.92
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.64
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one?
The IUPAC name of (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one (CID 130658822) is (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one.
What is the SMILES notation for (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one?
The canonical SMILES for (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one is O=C1COC[C@@H](c2ncccc2Cl)N1.
What is the InChIKey of (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one?
The InChIKey is OUBCOOZBIFLKKU-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H9ClN2O2/c10-6-2-1-3-11-9(6)7-4-14-5-8(13)12-7/h1-3,7H,4-5H2,(H,12,13)/t7-/m0/s1.
What are the key properties of (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one?
(5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one has a molecular weight of 212.64 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(3-chloro-2-pyridinyl)morpholin-3-one is sourced from PubChem (CID 130658822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).