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

C20H23NO — CID 10379653

IUPACphenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone
SMILESO=C(c1ccccc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C20H23NO/c22-20(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19H,11-16H2
InChIKeyGEFOLRNTTIQKBZ-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.82
Rot. Bonds5

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

phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone (PubChem CID 10379653) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone.

Molecular Properties

Compound Namephenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone
PubChem CID10379653
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Namephenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone
SMILESO=C(c1ccccc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C20H23NO/c22-20(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19H,11-16H2
InChIKeyGEFOLRNTTIQKBZ-UHFFFAOYSA-N
XLogP3.82
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone?
The IUPAC name of phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone (CID 10379653) is phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone.
What is the SMILES notation for phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone?
The canonical SMILES for phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone is O=C(c1ccccc1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone?
The InChIKey is GEFOLRNTTIQKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c22-20(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19H,11-16H2.
What are the key properties of phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone?
phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone has a molecular weight of 293.41 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[1-(2-phenylethyl)piperidin-4-yl]methanone is sourced from PubChem (CID 10379653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).