4-fluoro-N-(2-morpholin-4-ylethyl)benzamide

C13H17FN2O2 — CID 835134

IUPAC4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C13H17FN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
InChIKeyNOMMINDFYOPRPU-UHFFFAOYSA-N
MW252.29 g/mol
LogP0.89
Rot. Bonds4

About 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide

4-fluoro-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 835134) has the molecular formula C13H17FN2O2 and a molecular weight of 252.29 g/mol. Its IUPAC name is 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID835134
Molecular FormulaC13H17FN2O2
Molecular Weight252.29 g/mol
Exact Mass252.13
IUPAC Name4-fluoro-N-(2-morpholin-4-ylethyl)benzamide
SMILESO=C(NCCN1CCOCC1)c1ccc(F)cc1
InChIInChI=1S/C13H17FN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)
InChIKeyNOMMINDFYOPRPU-UHFFFAOYSA-N
XLogP0.89
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.29
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide (CID 835134) is 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide is O=C(NCCN1CCOCC1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is NOMMINDFYOPRPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17).
What are the key properties of 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide?
4-fluoro-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 252.29 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 835134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).