N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide

C20H22N2O2 — CID 95907396

IUPACN-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1C(=O)C[C@@H](c2ccccc2)N(C)[C@@H]1c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-14(23)21-19-18(24)13-17(15-9-5-3-6-10-15)22(2)20(19)16-11-7-4-8-12-16/h3-12,17,19-20H,13H2,1-2H3,(H,21,23)/t17-,19-,20+/m0/s1
InChIKeyJDYAEPOVCTZWTD-YSIASYRMSA-N
MW322.41 g/mol
LogP2.88
Rot. Bonds3

About N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide

N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide (PubChem CID 95907396) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide
PubChem CID95907396
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide
SMILESCC(=O)N[C@H]1C(=O)C[C@@H](c2ccccc2)N(C)[C@@H]1c1ccccc1
InChIInChI=1S/C20H22N2O2/c1-14(23)21-19-18(24)13-17(15-9-5-3-6-10-15)22(2)20(19)16-11-7-4-8-12-16/h3-12,17,19-20H,13H2,1-2H3,(H,21,23)/t17-,19-,20+/m0/s1
InChIKeyJDYAEPOVCTZWTD-YSIASYRMSA-N
XLogP2.88
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide with MolForge

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Related Compounds

(2R,3R,6S)-1-methyl-2,3,6-triphenylpiperidin-4-one
CID 11909630
(2R,3S,6S)-1-acetyl-2,3,6-triphenylpiperidin-4-one
CID 11894627
[(E)-(3-ethyl-1-methyl-2,6-diphenylpiperidin-4-ylidene)amino] methyl carbonate
CID 71624715
1,3-dimethyl-2,6-diphenylpiperidin-4-ol
CID 2729803
(2R,3S,4S,6S)-1,3-dimethyl-2,6-diphenylpiperidin-4-ol
CID 6541757
(NZ)-N-[(2R,3R,6S)-1-methyl-2,3,6-triphenylpiperidin-4-ylidene]hydroxylamine
CID 11894630
ethyl 2-(3-acetamido-2-oxo-4-phenylazetidin-1-yl)-2-phenylacetate
CID 20522480
1-chloro-3-methyl-2,6-diphenylpiperidin-4-one
CID 13185093
(2S,3R,6R)-1-(2,2-dichloroacetyl)-3-ethyl-2,6-diphenylpiperidin-4-one
CID 139085589
N-[(2R,4S,10bS)-6-oxo-4-phenyl-2,3,4,10b-tetrahydro-1H-pyrido[2,1-a]isoindol-2-yl]acetamide
CID 72722563
N-[(2S,6R)-1-methyl-2,6-diphenylpiperidin-4-ylidene]hydroxylamine
CID 873157
(2S,3R,4R)-4-hydroxy-1-methyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid
CID 122155387

Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide?
The IUPAC name of N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide (CID 95907396) is N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide.
What is the SMILES notation for N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide?
The canonical SMILES for N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide is CC(=O)N[C@H]1C(=O)C[C@@H](c2ccccc2)N(C)[C@@H]1c1ccccc1.
What is the InChIKey of N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide?
The InChIKey is JDYAEPOVCTZWTD-YSIASYRMSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-14(23)21-19-18(24)13-17(15-9-5-3-6-10-15)22(2)20(19)16-11-7-4-8-12-16/h3-12,17,19-20H,13H2,1-2H3,(H,21,23)/t17-,19-,20+/m0/s1.
What are the key properties of N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide?
N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide has a molecular weight of 322.41 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R,6S)-1-methyl-4-oxo-2,6-diphenylpiperidin-3-yl]acetamide is sourced from PubChem (CID 95907396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).