4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one

C22H26N2O2 — CID 162533417

IUPAC4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one
SMILESCC1COCCN1C1CC(=O)NC(c2ccccc2-c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c1-16-15-26-12-11-24(16)18-13-21(23-22(25)14-18)20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,16,18,21H,11-15H2,1H3,(H,23,25)
InChIKeyJHHZZBWKMCRCKV-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.39
Rot. Bonds3

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

4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one (PubChem CID 162533417) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one.

Molecular Properties

Compound Name4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one
PubChem CID162533417
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one
SMILESCC1COCCN1C1CC(=O)NC(c2ccccc2-c2ccccc2)C1
InChIInChI=1S/C22H26N2O2/c1-16-15-26-12-11-24(16)18-13-21(23-22(25)14-18)20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,16,18,21H,11-15H2,1H3,(H,23,25)
InChIKeyJHHZZBWKMCRCKV-UHFFFAOYSA-N
XLogP3.39
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one?
The IUPAC name of 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one (CID 162533417) is 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one.
What is the SMILES notation for 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one?
The canonical SMILES for 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one is CC1COCCN1C1CC(=O)NC(c2ccccc2-c2ccccc2)C1.
What is the InChIKey of 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one?
The InChIKey is JHHZZBWKMCRCKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-16-15-26-12-11-24(16)18-13-21(23-22(25)14-18)20-10-6-5-9-19(20)17-7-3-2-4-8-17/h2-10,16,18,21H,11-15H2,1H3,(H,23,25).
What are the key properties of 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one?
4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one has a molecular weight of 350.46 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylmorpholin-4-yl)-6-(2-phenylphenyl)piperidin-2-one is sourced from PubChem (CID 162533417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).