N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide

C15H21FN2O2 — CID 47103101

IUPACN-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)NCCc1ccc(F)cc1)N1CCOCC1
InChIInChI=1S/C15H21FN2O2/c1-12(18-8-10-20-11-9-18)15(19)17-7-6-13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3,(H,17,19)
InChIKeyBQOCFZVEUXIRHB-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.21
Rot. Bonds5

About N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide

N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide (PubChem CID 47103101) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide
PubChem CID47103101
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide
SMILESCC(C(=O)NCCc1ccc(F)cc1)N1CCOCC1
InChIInChI=1S/C15H21FN2O2/c1-12(18-8-10-20-11-9-18)15(19)17-7-6-13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3,(H,17,19)
InChIKeyBQOCFZVEUXIRHB-UHFFFAOYSA-N
XLogP1.21
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide (CID 47103101) is N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide is CC(C(=O)NCCc1ccc(F)cc1)N1CCOCC1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide?
The InChIKey is BQOCFZVEUXIRHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-12(18-8-10-20-11-9-18)15(19)17-7-6-13-2-4-14(16)5-3-13/h2-5,12H,6-11H2,1H3,(H,17,19).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide?
N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide has a molecular weight of 280.34 g/mol, XLogP of 1.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-morpholin-4-ylpropanamide is sourced from PubChem (CID 47103101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).