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

C21H26N2O — CID 527015

IUPACN-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C21H26N2O/c1-18(24)23(20-10-6-3-7-11-20)21-13-16-22(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,21H,12-17H2,1H3
InChIKeyFYIUUQUPOKIKNI-UHFFFAOYSA-N
MW322.45 g/mol
LogP3.75
Rot. Bonds5

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

N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (PubChem CID 527015) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
PubChem CID527015
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC NameN-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C21H26N2O/c1-18(24)23(20-10-6-3-7-11-20)21-13-16-22(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,21H,12-17H2,1H3
InChIKeyFYIUUQUPOKIKNI-UHFFFAOYSA-N
XLogP3.75
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 53.75
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-phenylethyl)piperidin-4-yl]acetamide?
The IUPAC name of N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (CID 527015) is N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide is CC(=O)N(c1ccccc1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The InChIKey is FYIUUQUPOKIKNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-18(24)23(20-10-6-3-7-11-20)21-13-16-22(17-14-21)15-12-19-8-4-2-5-9-19/h2-11,21H,12-17H2,1H3.
What are the key properties of N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide has a molecular weight of 322.45 g/mol, XLogP of 3.75, 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-phenylethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 527015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).