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

C22H27FN2O — CID 164851914

IUPACN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C22H27FN2O/c1-18(26)25(17-20-7-9-21(23)10-8-20)22-12-15-24(16-13-22)14-11-19-5-3-2-4-6-19/h2-10,22H,11-17H2,1H3
InChIKeyHCEOYFCRTFQYLI-UHFFFAOYSA-N
MW354.47 g/mol
LogP3.88
Rot. Bonds6

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

N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (PubChem CID 164851914) has the molecular formula C22H27FN2O and a molecular weight of 354.47 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
PubChem CID164851914
Molecular FormulaC22H27FN2O
Molecular Weight354.47 g/mol
Exact Mass354.21
IUPAC NameN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide
SMILESCC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C22H27FN2O/c1-18(26)25(17-20-7-9-21(23)10-8-20)22-12-15-24(16-13-22)14-11-19-5-3-2-4-6-19/h2-10,22H,11-17H2,1H3
InChIKeyHCEOYFCRTFQYLI-UHFFFAOYSA-N
XLogP3.88
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.47
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide (CID 164851914) is N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide is CC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
The InChIKey is HCEOYFCRTFQYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27FN2O/c1-18(26)25(17-20-7-9-21(23)10-8-20)22-12-15-24(16-13-22)14-11-19-5-3-2-4-6-19/h2-10,22H,11-17H2,1H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide?
N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide has a molecular weight of 354.47 g/mol, XLogP of 3.88, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 164851914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).