[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone

C23H27FN2O2 — CID 134797935

IUPAC[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(Cc2ccccc2-c2ccccc2F)CC1)N1CCOCC1
InChIInChI=1S/C23H27FN2O2/c24-22-8-4-3-7-21(22)20-6-2-1-5-19(20)17-25-11-9-18(10-12-25)23(27)26-13-15-28-16-14-26/h1-8,18H,9-17H2
InChIKeyOMIHKASFJWJMPX-UHFFFAOYSA-N
MW382.48 g/mol
LogP3.56
Rot. Bonds4

About [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone

[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 134797935) has the molecular formula C23H27FN2O2 and a molecular weight of 382.48 g/mol. Its IUPAC name is [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID134797935
Molecular FormulaC23H27FN2O2
Molecular Weight382.48 g/mol
Exact Mass382.21
IUPAC Name[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(Cc2ccccc2-c2ccccc2F)CC1)N1CCOCC1
InChIInChI=1S/C23H27FN2O2/c24-22-8-4-3-7-21(22)20-6-2-1-5-19(20)17-25-11-9-18(10-12-25)23(27)26-13-15-28-16-14-26/h1-8,18H,9-17H2
InChIKeyOMIHKASFJWJMPX-UHFFFAOYSA-N
XLogP3.56
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.48
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone (CID 134797935) is [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(Cc2ccccc2-c2ccccc2F)CC1)N1CCOCC1.
What is the InChIKey of [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is OMIHKASFJWJMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27FN2O2/c24-22-8-4-3-7-21(22)20-6-2-1-5-19(20)17-25-11-9-18(10-12-25)23(27)26-13-15-28-16-14-26/h1-8,18H,9-17H2.
What are the key properties of [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone?
[1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 382.48 g/mol, XLogP of 3.56, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[2-(2-fluorophenyl)phenyl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 134797935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).