3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide

C19H21FN2O2 — CID 16892430

IUPAC3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)c1cccc(F)c1
InChIInChI=1S/C19H21FN2O2/c20-17-8-4-7-16(13-17)19(23)21-9-10-22-11-12-24-18(14-22)15-5-2-1-3-6-15/h1-8,13,18H,9-12,14H2,(H,21,23)
InChIKeyOKGNIJFVCDBNGD-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.63
Rot. Bonds5

About 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide

3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide (PubChem CID 16892430) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
PubChem CID16892430
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC Name3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)c1cccc(F)c1
InChIInChI=1S/C19H21FN2O2/c20-17-8-4-7-16(13-17)19(23)21-9-10-22-11-12-24-18(14-22)15-5-2-1-3-6-15/h1-8,13,18H,9-12,14H2,(H,21,23)
InChIKeyOKGNIJFVCDBNGD-UHFFFAOYSA-N
XLogP2.63
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The IUPAC name of 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide (CID 16892430) is 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide.
What is the SMILES notation for 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The canonical SMILES for 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide is O=C(NCCN1CCOC(c2ccccc2)C1)c1cccc(F)c1.
What is the InChIKey of 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The InChIKey is OKGNIJFVCDBNGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c20-17-8-4-7-16(13-17)19(23)21-9-10-22-11-12-24-18(14-22)15-5-2-1-3-6-15/h1-8,13,18H,9-12,14H2,(H,21,23).
What are the key properties of 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide has a molecular weight of 328.39 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide is sourced from PubChem (CID 16892430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).