N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide

C21H26N2O — CID 97120184

IUPACN-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)CN1CCC[C@](C)(c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-21(18-10-5-3-6-11-18)14-9-15-23(17-21)16-20(24)22(2)19-12-7-4-8-13-19/h3-8,10-13H,9,14-17H2,1-2H3/t21-/m0/s1
InChIKeyZLFGWDIVPSGOOL-NRFANRHFSA-N
MW322.45 g/mol
LogP3.70
Rot. Bonds4

About N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide

N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide (PubChem CID 97120184) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound NameN-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide
PubChem CID97120184
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC NameN-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide
SMILESCN(C(=O)CN1CCC[C@](C)(c2ccccc2)C1)c1ccccc1
InChIInChI=1S/C21H26N2O/c1-21(18-10-5-3-6-11-18)14-9-15-23(17-21)16-20(24)22(2)19-12-7-4-8-13-19/h3-8,10-13H,9,14-17H2,1-2H3/t21-/m0/s1
InChIKeyZLFGWDIVPSGOOL-NRFANRHFSA-N
XLogP3.70
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-[2-(N-methylanilino)-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 63148892
(3S)-3-methyl-1-(2-methylsulfonylethyl)-3-phenylpiperidine
CID 96540288
N-methyl-N-phenyl-3-piperidin-1-ylpropanamide
CID 110688340
2-(4-benzylpiperazin-1-yl)-N-methyl-N-phenylacetamide
CID 44768291
2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
CID 55099876
(3S)-3-methyl-1-(3-methylsulfonylpropyl)-3-phenylpiperidine
CID 96540298
3-[4-[2-(N-methylanilino)-2-oxoethyl]piperazin-1-yl]propanoic acid
CID 134069440
(2R)-1-methoxy-3-[(3S)-3-methyl-3-phenylpiperidin-1-yl]propan-2-ol
CID 99103988
N-methyl-N-(4-methylphenyl)-2-piperidin-1-ylacetamide
CID 21061007
N-(4-aminophenyl)-N-methyl-2-piperidin-1-ylacetamide
CID 22569644
2-(4-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
CID 62656804
2-[2-(hydroxymethyl)morpholin-4-yl]-N-methyl-N-phenylacetamide
CID 79833459

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide?
The IUPAC name of N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide (CID 97120184) is N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide?
The canonical SMILES for N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide is CN(C(=O)CN1CCC[C@](C)(c2ccccc2)C1)c1ccccc1.
What is the InChIKey of N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide?
The InChIKey is ZLFGWDIVPSGOOL-NRFANRHFSA-N. The full InChI is InChI=1S/C21H26N2O/c1-21(18-10-5-3-6-11-18)14-9-15-23(17-21)16-20(24)22(2)19-12-7-4-8-13-19/h3-8,10-13H,9,14-17H2,1-2H3/t21-/m0/s1.
What are the key properties of N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide?
N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide has a molecular weight of 322.45 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(3R)-3-methyl-3-phenylpiperidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 97120184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).