2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide

C24H33N5O2 — CID 78880245

IUPAC2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide
SMILESCN(C)CC(NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H33N5O2/c1-28(2)17-22(19-9-5-3-6-10-19)27-24(31)26-21-13-15-29(16-14-21)18-23(30)25-20-11-7-4-8-12-20/h3-12,21-22H,13-18H2,1-2H3,(H,25,30)(H2,26,27,31)
InChIKeyWSAHAFCJVIONPO-UHFFFAOYSA-N
MW423.56 g/mol
LogP2.69
Rot. Bonds8

About 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide

2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide (PubChem CID 78880245) has the molecular formula C24H33N5O2 and a molecular weight of 423.56 g/mol. Its IUPAC name is 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide
PubChem CID78880245
Molecular FormulaC24H33N5O2
Molecular Weight423.56 g/mol
Exact Mass423.26
IUPAC Name2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide
SMILESCN(C)CC(NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C24H33N5O2/c1-28(2)17-22(19-9-5-3-6-10-19)27-24(31)26-21-13-15-29(16-14-21)18-23(30)25-20-11-7-4-8-12-20/h3-12,21-22H,13-18H2,1-2H3,(H,25,30)(H2,26,27,31)
InChIKeyWSAHAFCJVIONPO-UHFFFAOYSA-N
XLogP2.69
TPSA76.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.56
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide with MolForge

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Related Compounds

N-[3-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]amino]-3-oxo-1-phenylpropyl]benzamide
CID 55518864
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,2-dimethylpropanamide
CID 3220730
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-4-(dimethylamino)benzamide
CID 42014034
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(benzylcarbamoylamino)-3-methylbutanamide
CID 55548209
4-amino-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]pentanamide
CID 120564436
(2R)-N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2-(carbamoylamino)-3-methylbutanamide
CID 29326396
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclobutanecarboxamide
CID 16589812
N-[4-[[1-(2-anilino-2-oxoethyl)piperidin-4-yl]amino]-4-oxobutan-2-yl]benzamide
CID 24629855
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-1-methylpyrazole-4-carboxamide
CID 18146068
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]cyclohexanecarboxamide
CID 3220728
N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 42940797
2-(4-hydroxypiperidin-1-yl)-N-phenylacetamide
CID 39902294

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide?
The IUPAC name of 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide (CID 78880245) is 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide?
The canonical SMILES for 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide is CN(C)CC(NC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1)c1ccccc1.
What is the InChIKey of 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide?
The InChIKey is WSAHAFCJVIONPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N5O2/c1-28(2)17-22(19-9-5-3-6-10-19)27-24(31)26-21-13-15-29(16-14-21)18-23(30)25-20-11-7-4-8-12-20/h3-12,21-22H,13-18H2,1-2H3,(H,25,30)(H2,26,27,31).
What are the key properties of 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide?
2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide has a molecular weight of 423.56 g/mol, XLogP of 2.69, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[2-(dimethylamino)-1-phenylethyl]carbamoylamino]piperidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 78880245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).