(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one

C10H12N2O2 — CID 130665369

IUPAC(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one
SMILESCc1cccc([C@H]2COCC(=O)N2)n1
InChIInChI=1S/C10H12N2O2/c1-7-3-2-4-8(11-7)9-5-14-6-10(13)12-9/h2-4,9H,5-6H2,1H3,(H,12,13)/t9-/m1/s1
InChIKeyWIKAIWZOOQQUSF-SECBINFHSA-N
MW192.22 g/mol
LogP0.58
Rot. Bonds1

About (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one

(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one (PubChem CID 130665369) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one.

Molecular Properties

Compound Name(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one
PubChem CID130665369
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one
SMILESCc1cccc([C@H]2COCC(=O)N2)n1
InChIInChI=1S/C10H12N2O2/c1-7-3-2-4-8(11-7)9-5-14-6-10(13)12-9/h2-4,9H,5-6H2,1H3,(H,12,13)/t9-/m1/s1
InChIKeyWIKAIWZOOQQUSF-SECBINFHSA-N
XLogP0.58
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one?
The IUPAC name of (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one (CID 130665369) is (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one.
What is the SMILES notation for (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one?
The canonical SMILES for (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one is Cc1cccc([C@H]2COCC(=O)N2)n1.
What is the InChIKey of (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one?
The InChIKey is WIKAIWZOOQQUSF-SECBINFHSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-7-3-2-4-8(11-7)9-5-14-6-10(13)12-9/h2-4,9H,5-6H2,1H3,(H,12,13)/t9-/m1/s1.
What are the key properties of (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one?
(5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one has a molecular weight of 192.22 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-(6-methyl-2-pyridinyl)morpholin-3-one is sourced from PubChem (CID 130665369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).