(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

C18H24F2N2O2 — CID 53193430

IUPAC(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESO=C(c1cc(F)ccc1F)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C18H24F2N2O2/c19-14-4-5-17(20)16(13-14)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2
InChIKeyFQCSWZMLXONGDS-UHFFFAOYSA-N
MW338.40 g/mol
LogP2.68
Rot. Bonds4

About (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (PubChem CID 53193430) has the molecular formula C18H24F2N2O2 and a molecular weight of 338.40 g/mol. Its IUPAC name is (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
PubChem CID53193430
Molecular FormulaC18H24F2N2O2
Molecular Weight338.40 g/mol
Exact Mass338.18
IUPAC Name(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESO=C(c1cc(F)ccc1F)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C18H24F2N2O2/c19-14-4-5-17(20)16(13-14)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2
InChIKeyFQCSWZMLXONGDS-UHFFFAOYSA-N
XLogP2.68
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.40
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The IUPAC name of (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (CID 53193430) is (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The canonical SMILES for (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is O=C(c1cc(F)ccc1F)N1CCCCC1CCN1CCOCC1.
What is the InChIKey of (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The InChIKey is FQCSWZMLXONGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F2N2O2/c19-14-4-5-17(20)16(13-14)18(23)22-7-2-1-3-15(22)6-8-21-9-11-24-12-10-21/h4-5,13,15H,1-3,6-12H2.
What are the key properties of (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
(2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone has a molecular weight of 338.40 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 53193430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).