(5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one

C9H9ClN2O2 — CID 129415968

IUPAC(5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one
SMILESO=C1COC[C@@H](c2cnccc2Cl)N1
InChIInChI=1S/C9H9ClN2O2/c10-7-1-2-11-3-6(7)8-4-14-5-9(13)12-8/h1-3,8H,4-5H2,(H,12,13)/t8-/m0/s1
InChIKeyAIXBGBANURVCBM-QMMMGPOBSA-N
MW212.64 g/mol
LogP0.92
Rot. Bonds1

About (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one

(5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one (PubChem CID 129415968) has the molecular formula C9H9ClN2O2 and a molecular weight of 212.64 g/mol. Its IUPAC name is (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one.

Molecular Properties

Compound Name(5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one
PubChem CID129415968
Molecular FormulaC9H9ClN2O2
Molecular Weight212.64 g/mol
Exact Mass212.04
IUPAC Name(5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one
SMILESO=C1COC[C@@H](c2cnccc2Cl)N1
InChIInChI=1S/C9H9ClN2O2/c10-7-1-2-11-3-6(7)8-4-14-5-9(13)12-8/h1-3,8H,4-5H2,(H,12,13)/t8-/m0/s1
InChIKeyAIXBGBANURVCBM-QMMMGPOBSA-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-(4-chloro-3-pyridinyl)morpholin-3-one?
The IUPAC name of (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one (CID 129415968) is (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one.
What is the SMILES notation for (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one?
The canonical SMILES for (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one is O=C1COC[C@@H](c2cnccc2Cl)N1.
What is the InChIKey of (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one?
The InChIKey is AIXBGBANURVCBM-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H9ClN2O2/c10-7-1-2-11-3-6(7)8-4-14-5-9(13)12-8/h1-3,8H,4-5H2,(H,12,13)/t8-/m0/s1.
What are the key properties of (5R)-5-(4-chloro-3-pyridinyl)morpholin-3-one?
(5R)-5-(4-chloro-3-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-(4-chloro-3-pyridinyl)morpholin-3-one is sourced from PubChem (CID 129415968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).