2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone

C17H23FN2O2 — CID 16674775

IUPAC2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(CN1CCC(c2ccc(F)cc2)CC1)N1CCOCC1
InChIInChI=1S/C17H23FN2O2/c18-16-3-1-14(2-4-16)15-5-7-19(8-6-15)13-17(21)20-9-11-22-12-10-20/h1-4,15H,5-13H2
InChIKeyWPGLTVCVKBUTGW-UHFFFAOYSA-N
MW306.38 g/mol
LogP1.86
Rot. Bonds3

About 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone

2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 16674775) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone
PubChem CID16674775
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC Name2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(CN1CCC(c2ccc(F)cc2)CC1)N1CCOCC1
InChIInChI=1S/C17H23FN2O2/c18-16-3-1-14(2-4-16)15-5-7-19(8-6-15)13-17(21)20-9-11-22-12-10-20/h1-4,15H,5-13H2
InChIKeyWPGLTVCVKBUTGW-UHFFFAOYSA-N
XLogP1.86
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone (CID 16674775) is 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone is O=C(CN1CCC(c2ccc(F)cc2)CC1)N1CCOCC1.
What is the InChIKey of 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is WPGLTVCVKBUTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c18-16-3-1-14(2-4-16)15-5-7-19(8-6-15)13-17(21)20-9-11-22-12-10-20/h1-4,15H,5-13H2.
What are the key properties of 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone?
2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 306.38 g/mol, XLogP of 1.86, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorophenyl)piperidin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 16674775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).