4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one

C16H23N3O2 — CID 162533415

IUPAC4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one
SMILESCc1ccncc1C1CC(N2CCOCC2C)CC(=O)N1
InChIInChI=1S/C16H23N3O2/c1-11-3-4-17-9-14(11)15-7-13(8-16(20)18-15)19-5-6-21-10-12(19)2/h3-4,9,12-13,15H,5-8,10H2,1-2H3,(H,18,20)
InChIKeyIRAWJECCNRWBSJ-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.43
Rot. Bonds2

About 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one

4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one (PubChem CID 162533415) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one.

Molecular Properties

Compound Name4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one
PubChem CID162533415
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one
SMILESCc1ccncc1C1CC(N2CCOCC2C)CC(=O)N1
InChIInChI=1S/C16H23N3O2/c1-11-3-4-17-9-14(11)15-7-13(8-16(20)18-15)19-5-6-21-10-12(19)2/h3-4,9,12-13,15H,5-8,10H2,1-2H3,(H,18,20)
InChIKeyIRAWJECCNRWBSJ-UHFFFAOYSA-N
XLogP1.43
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one?
The IUPAC name of 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one (CID 162533415) is 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one.
What is the SMILES notation for 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one?
The canonical SMILES for 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one is Cc1ccncc1C1CC(N2CCOCC2C)CC(=O)N1.
What is the InChIKey of 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one?
The InChIKey is IRAWJECCNRWBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-11-3-4-17-9-14(11)15-7-13(8-16(20)18-15)19-5-6-21-10-12(19)2/h3-4,9,12-13,15H,5-8,10H2,1-2H3,(H,18,20).
What are the key properties of 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one?
4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one has a molecular weight of 289.38 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylmorpholin-4-yl)-6-(4-methyl-3-pyridinyl)piperidin-2-one is sourced from PubChem (CID 162533415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).