2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide

C18H24FN3O3 — CID 43816597

IUPAC2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)CN2CCOCC2)CC1)c1ccccc1F
InChIInChI=1S/C18H24FN3O3/c19-16-4-2-1-3-15(16)18(24)20-14-5-7-22(8-6-14)17(23)13-21-9-11-25-12-10-21/h1-4,14H,5-13H2,(H,20,24)
InChIKeyWVHKQXKRMOYYSU-UHFFFAOYSA-N
MW349.41 g/mol
LogP0.88
Rot. Bonds4

About 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide

2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide (PubChem CID 43816597) has the molecular formula C18H24FN3O3 and a molecular weight of 349.41 g/mol. Its IUPAC name is 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide
PubChem CID43816597
Molecular FormulaC18H24FN3O3
Molecular Weight349.41 g/mol
Exact Mass349.18
IUPAC Name2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide
SMILESO=C(NC1CCN(C(=O)CN2CCOCC2)CC1)c1ccccc1F
InChIInChI=1S/C18H24FN3O3/c19-16-4-2-1-3-15(16)18(24)20-14-5-7-22(8-6-14)17(23)13-21-9-11-25-12-10-21/h1-4,14H,5-13H2,(H,20,24)
InChIKeyWVHKQXKRMOYYSU-UHFFFAOYSA-N
XLogP0.88
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide?
The IUPAC name of 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide (CID 43816597) is 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide?
The canonical SMILES for 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide is O=C(NC1CCN(C(=O)CN2CCOCC2)CC1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide?
The InChIKey is WVHKQXKRMOYYSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN3O3/c19-16-4-2-1-3-15(16)18(24)20-14-5-7-22(8-6-14)17(23)13-21-9-11-25-12-10-21/h1-4,14H,5-13H2,(H,20,24).
What are the key properties of 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide?
2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide has a molecular weight of 349.41 g/mol, XLogP of 0.88, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 43816597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).