[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone

C11H18N2O2 — CID 162394456

IUPAC[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone
SMILESC[C@H]1C=CCCN1C(=O)N1CCOCC1
InChIInChI=1S/C11H18N2O2/c1-10-4-2-3-5-13(10)11(14)12-6-8-15-9-7-12/h2,4,10H,3,5-9H2,1H3/t10-/m0/s1
InChIKeyUMDVIWOAFDEGOC-JTQLQIEISA-N
MW210.28 g/mol
LogP1.09
Rot. Bonds

About [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone

[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone (PubChem CID 162394456) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone
PubChem CID162394456
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone
SMILESC[C@H]1C=CCCN1C(=O)N1CCOCC1
InChIInChI=1S/C11H18N2O2/c1-10-4-2-3-5-13(10)11(14)12-6-8-15-9-7-12/h2,4,10H,3,5-9H2,1H3/t10-/m0/s1
InChIKeyUMDVIWOAFDEGOC-JTQLQIEISA-N
XLogP1.09
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone (CID 162394456) is [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone is C[C@H]1C=CCCN1C(=O)N1CCOCC1.
What is the InChIKey of [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone?
The InChIKey is UMDVIWOAFDEGOC-JTQLQIEISA-N. The full InChI is InChI=1S/C11H18N2O2/c1-10-4-2-3-5-13(10)11(14)12-6-8-15-9-7-12/h2,4,10H,3,5-9H2,1H3/t10-/m0/s1.
What are the key properties of [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone?
[(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone has a molecular weight of 210.28 g/mol, XLogP of 1.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(6S)-6-methyl-3,6-dihydro-2H-pyridin-1-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 162394456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).