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

C21H26N2O — CID 10969339

IUPAC2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESO=C(Cc1ccccc1)NC1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C21H26N2O/c24-21(17-19-9-5-2-6-10-19)22-20-12-15-23(16-13-20)14-11-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,22,24)
InChIKeyJHFQTHKDGZYAPG-UHFFFAOYSA-N
MW322.45 g/mol
LogP3.05
Rot. Bonds6

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

2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (PubChem CID 10969339) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
PubChem CID10969339
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC Name2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESO=C(Cc1ccccc1)NC1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C21H26N2O/c24-21(17-19-9-5-2-6-10-19)22-20-12-15-23(16-13-20)14-11-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,22,24)
InChIKeyJHFQTHKDGZYAPG-UHFFFAOYSA-N
XLogP3.05
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (CID 10969339) is 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide is O=C(Cc1ccccc1)NC1CCN(CCc2ccccc2)CC1.
What is the InChIKey of 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The InChIKey is JHFQTHKDGZYAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c24-21(17-19-9-5-2-6-10-19)22-20-12-15-23(16-13-20)14-11-18-7-3-1-4-8-18/h1-10,20H,11-17H2,(H,22,24).
What are the key properties of 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide has a molecular weight of 322.45 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 10969339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).