3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine

C16H24FNO — CID 116546585

IUPAC3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine
SMILESCCCc1cccc(C(C)(F)CC2COCCN2)c1
InChIInChI=1S/C16H24FNO/c1-3-5-13-6-4-7-14(10-13)16(2,17)11-15-12-19-9-8-18-15/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3
InChIKeyJVQQXLZMHLURNJ-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.20
Rot. Bonds5

About 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine

3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine (PubChem CID 116546585) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine.

Molecular Properties

Compound Name3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine
PubChem CID116546585
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine
SMILESCCCc1cccc(C(C)(F)CC2COCCN2)c1
InChIInChI=1S/C16H24FNO/c1-3-5-13-6-4-7-14(10-13)16(2,17)11-15-12-19-9-8-18-15/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3
InChIKeyJVQQXLZMHLURNJ-UHFFFAOYSA-N
XLogP3.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine 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 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine?
The IUPAC name of 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine (CID 116546585) is 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine.
What is the SMILES notation for 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine?
The canonical SMILES for 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine is CCCc1cccc(C(C)(F)CC2COCCN2)c1.
What is the InChIKey of 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine?
The InChIKey is JVQQXLZMHLURNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-3-5-13-6-4-7-14(10-13)16(2,17)11-15-12-19-9-8-18-15/h4,6-7,10,15,18H,3,5,8-9,11-12H2,1-2H3.
What are the key properties of 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine?
3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine has a molecular weight of 265.37 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-fluoro-2-(3-propylphenyl)propyl]morpholine is sourced from PubChem (CID 116546585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).