N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide

C15H21FN2O2 — CID 66427852

IUPACN-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide
SMILESCCN(Cc1cccc(F)c1)C(=O)CC1CNCCO1
InChIInChI=1S/C15H21FN2O2/c1-2-18(11-12-4-3-5-13(16)8-12)15(19)9-14-10-17-6-7-20-14/h3-5,8,14,17H,2,6-7,9-11H2,1H3
InChIKeyXJTIKLVFPVILHZ-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.55
Rot. Bonds5

About N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide

N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide (PubChem CID 66427852) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide
PubChem CID66427852
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide
SMILESCCN(Cc1cccc(F)c1)C(=O)CC1CNCCO1
InChIInChI=1S/C15H21FN2O2/c1-2-18(11-12-4-3-5-13(16)8-12)15(19)9-14-10-17-6-7-20-14/h3-5,8,14,17H,2,6-7,9-11H2,1H3
InChIKeyXJTIKLVFPVILHZ-UHFFFAOYSA-N
XLogP1.55
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 ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide?
The IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide (CID 66427852) is N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide?
The canonical SMILES for N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide is CCN(Cc1cccc(F)c1)C(=O)CC1CNCCO1.
What is the InChIKey of N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide?
The InChIKey is XJTIKLVFPVILHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-2-18(11-12-4-3-5-13(16)8-12)15(19)9-14-10-17-6-7-20-14/h3-5,8,14,17H,2,6-7,9-11H2,1H3.
What are the key properties of N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide?
N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide has a molecular weight of 280.34 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-fluorophenyl)methyl]-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66427852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).