N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide

C15H21FN2O2 — CID 17452218

IUPACN-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide
SMILESCC1CN(CC(=O)NC(C)c2ccc(F)cc2)CCO1
InChIInChI=1S/C15H21FN2O2/c1-11-9-18(7-8-20-11)10-15(19)17-12(2)13-3-5-14(16)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,17,19)
InChIKeyCCBVDWKNYWISQY-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.72
Rot. Bonds4

About N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide

N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide (PubChem CID 17452218) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide
PubChem CID17452218
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC NameN-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide
SMILESCC1CN(CC(=O)NC(C)c2ccc(F)cc2)CCO1
InChIInChI=1S/C15H21FN2O2/c1-11-9-18(7-8-20-11)10-15(19)17-12(2)13-3-5-14(16)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,17,19)
InChIKeyCCBVDWKNYWISQY-UHFFFAOYSA-N
XLogP1.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide?
The IUPAC name of N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide (CID 17452218) is N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide?
The canonical SMILES for N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide is CC1CN(CC(=O)NC(C)c2ccc(F)cc2)CCO1.
What is the InChIKey of N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide?
The InChIKey is CCBVDWKNYWISQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-11-9-18(7-8-20-11)10-15(19)17-12(2)13-3-5-14(16)6-4-13/h3-6,11-12H,7-10H2,1-2H3,(H,17,19).
What are the key properties of N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide?
N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide has a molecular weight of 280.34 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)ethyl]-2-(2-methylmorpholin-4-yl)acetamide is sourced from PubChem (CID 17452218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).