N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide

C22H28N2O — CID 615726

IUPACN-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccccc1)C1CCN(CC(C)c2ccccc2)CC1
InChIInChI=1S/C22H28N2O/c1-18(20-9-5-3-6-10-20)17-23-15-13-22(14-16-23)24(19(2)25)21-11-7-4-8-12-21/h3-12,18,22H,13-17H2,1-2H3
InChIKeyMDRBZPCJVBUXSG-UHFFFAOYSA-N
MW336.48 g/mol
LogP4.31
Rot. Bonds5

About N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide

N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide (PubChem CID 615726) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide
PubChem CID615726
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC NameN-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccccc1)C1CCN(CC(C)c2ccccc2)CC1
InChIInChI=1S/C22H28N2O/c1-18(20-9-5-3-6-10-20)17-23-15-13-22(14-16-23)24(19(2)25)21-11-7-4-8-12-21/h3-12,18,22H,13-17H2,1-2H3
InChIKeyMDRBZPCJVBUXSG-UHFFFAOYSA-N
XLogP4.31
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide?
The IUPAC name of N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide (CID 615726) is N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide is CC(=O)N(c1ccccc1)C1CCN(CC(C)c2ccccc2)CC1.
What is the InChIKey of N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide?
The InChIKey is MDRBZPCJVBUXSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O/c1-18(20-9-5-3-6-10-20)17-23-15-13-22(14-16-23)24(19(2)25)21-11-7-4-8-12-21/h3-12,18,22H,13-17H2,1-2H3.
What are the key properties of N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide?
N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide has a molecular weight of 336.48 g/mol, XLogP of 4.31, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-[1-(2-phenylpropyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 615726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).