(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide

C22H28N2O2 — CID 124756158

IUPAC(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide
SMILESCO[C@H](C(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccccc1
InChIInChI=1S/C22H28N2O2/c1-24-15-13-22(14-16-24,19-11-7-4-8-12-19)17-23-21(25)20(26-2)18-9-5-3-6-10-18/h3-12,20H,13-17H2,1-2H3,(H,23,25)/t20-/m0/s1
InChIKeyRUXSJLIFGOPRDM-FQEVSTJZSA-N
MW352.48 g/mol
LogP3.15
Rot. Bonds6

About (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide

(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide (PubChem CID 124756158) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide
PubChem CID124756158
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC Name(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide
SMILESCO[C@H](C(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccccc1
InChIInChI=1S/C22H28N2O2/c1-24-15-13-22(14-16-24,19-11-7-4-8-12-19)17-23-21(25)20(26-2)18-9-5-3-6-10-18/h3-12,20H,13-17H2,1-2H3,(H,23,25)/t20-/m0/s1
InChIKeyRUXSJLIFGOPRDM-FQEVSTJZSA-N
XLogP3.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]propanamide
CID 119069555
N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-3-(4-methylpiperazin-1-yl)propanamide
CID 118776370
N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]pyrazolidine-4-carboxamide
CID 134127510
(2R)-2-methyl-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-3-(1,2,4-triazol-1-yl)propanamide
CID 125176400
N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-2,2-diphenylacetamide
CID 113090745
(2R)-N-[3-(4-hydroxypiperidin-1-yl)propyl]-2-methoxy-2-phenylacetamide
CID 110021427
3-(3,4-dimethoxyphenyl)-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]propanamide
CID 122194375
N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-6-oxo-1H-pyridine-2-carboxamide
CID 118790232
(2S)-2-methoxy-N-[(1-methylpiperidin-4-ylidene)amino]-2-phenylacetamide
CID 749864
2-(diethylamino)-2-phenyl-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 56538633
3-amino-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]pyrazine-2-carboxamide;ethane
CID 142821686
1-methoxy-3-[(1-phenylcyclopropyl)methyl]urea
CID 47159768

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide?
The IUPAC name of (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide (CID 124756158) is (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide?
The canonical SMILES for (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide is CO[C@H](C(=O)NCC1(c2ccccc2)CCN(C)CC1)c1ccccc1.
What is the InChIKey of (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide?
The InChIKey is RUXSJLIFGOPRDM-FQEVSTJZSA-N. The full InChI is InChI=1S/C22H28N2O2/c1-24-15-13-22(14-16-24,19-11-7-4-8-12-19)17-23-21(25)20(26-2)18-9-5-3-6-10-18/h3-12,20H,13-17H2,1-2H3,(H,23,25)/t20-/m0/s1.
What are the key properties of (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide?
(2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide has a molecular weight of 352.48 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methoxy-N-[(1-methyl-4-phenylpiperidin-4-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 124756158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).