N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide

C22H28N2O — CID 86268866

IUPACN-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide
SMILESCN(C(=O)Cc1ccccc1)[C@H](CN1CCCCC1)c1ccccc1
InChIInChI=1S/C22H28N2O/c1-23(22(25)17-19-11-5-2-6-12-19)21(20-13-7-3-8-14-20)18-24-15-9-4-10-16-24/h2-3,5-8,11-14,21H,4,9-10,15-18H2,1H3/t21-/m1/s1
InChIKeyPFQUFCVTPRXOSB-OAQYLSRUSA-N
MW336.48 g/mol
LogP3.91
Rot. Bonds6

About N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide

N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide (PubChem CID 86268866) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide.

Molecular Properties

Compound NameN-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide
PubChem CID86268866
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC NameN-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide
SMILESCN(C(=O)Cc1ccccc1)[C@H](CN1CCCCC1)c1ccccc1
InChIInChI=1S/C22H28N2O/c1-23(22(25)17-19-11-5-2-6-12-19)21(20-13-7-3-8-14-20)18-24-15-9-4-10-16-24/h2-3,5-8,11-14,21H,4,9-10,15-18H2,1H3/t21-/m1/s1
InChIKeyPFQUFCVTPRXOSB-OAQYLSRUSA-N
XLogP3.91
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-2-phenyl-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 3298213
N-methyl-2-phenyl-N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 86268656
ethane;N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 91275660
2-(4-aminophenyl)-N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide;hydrochloride
CID 10452010
N-methyl-2-(3-methylphenyl)-N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 118927562
N-methyl-2-(4-nitrophenyl)-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 10109550
2-(3,4-dimethylphenyl)-N-methyl-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 138739466
N-methyl-N-[1-[4-(methylsulfamoyl)phenyl]-2-pyrrolidin-1-ylethyl]-2-phenylacetamide;hydrochloride
CID 10161182
[2-[2-[methyl-(1-phenyl-2-pyrrolidin-1-ylethyl)amino]-2-oxoethyl]phenyl]methylcarbamic acid
CID 22253496
2-anthracen-9-yl-N-methyl-N-(1-phenyl-2-pyrrolidin-1-ylethyl)acetamide;hydrochloride
CID 10161599
2,2,2-trifluoro-N-methyl-N-[(1S)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide
CID 11779548
2-[2-(methanesulfonamido)phenyl]-N-methyl-N-[(1R)-1-phenyl-2-pyrrolidin-1-ylethyl]acetamide;methanesulfonic acid
CID 10229395

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide?
The IUPAC name of N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide (CID 86268866) is N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide.
What is the SMILES notation for N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide?
The canonical SMILES for N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide is CN(C(=O)Cc1ccccc1)[C@H](CN1CCCCC1)c1ccccc1.
What is the InChIKey of N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide?
The InChIKey is PFQUFCVTPRXOSB-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H28N2O/c1-23(22(25)17-19-11-5-2-6-12-19)21(20-13-7-3-8-14-20)18-24-15-9-4-10-16-24/h2-3,5-8,11-14,21H,4,9-10,15-18H2,1H3/t21-/m1/s1.
What are the key properties of N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide?
N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide has a molecular weight of 336.48 g/mol, XLogP of 3.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyl-N-[(1S)-1-phenyl-2-piperidin-1-ylethyl]acetamide is sourced from PubChem (CID 86268866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).