2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide

C16H23FN2O3 — CID 6498974

IUPAC2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide
SMILESCCC(Oc1ccccc1F)C(=O)NCCN1CCOCC1
InChIInChI=1S/C16H23FN2O3/c1-2-14(22-15-6-4-3-5-13(15)17)16(20)18-7-8-19-9-11-21-12-10-19/h3-6,14H,2,7-12H2,1H3,(H,18,20)
InChIKeyJATJLVXZQDGKBZ-UHFFFAOYSA-N
MW310.37 g/mol
LogP1.43
Rot. Bonds7

About 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide

2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide (PubChem CID 6498974) has the molecular formula C16H23FN2O3 and a molecular weight of 310.37 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide
PubChem CID6498974
Molecular FormulaC16H23FN2O3
Molecular Weight310.37 g/mol
Exact Mass310.17
IUPAC Name2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide
SMILESCCC(Oc1ccccc1F)C(=O)NCCN1CCOCC1
InChIInChI=1S/C16H23FN2O3/c1-2-14(22-15-6-4-3-5-13(15)17)16(20)18-7-8-19-9-11-21-12-10-19/h3-6,14H,2,7-12H2,1H3,(H,18,20)
InChIKeyJATJLVXZQDGKBZ-UHFFFAOYSA-N
XLogP1.43
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide (CID 6498974) is 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide is CCC(Oc1ccccc1F)C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide?
The InChIKey is JATJLVXZQDGKBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O3/c1-2-14(22-15-6-4-3-5-13(15)17)16(20)18-7-8-19-9-11-21-12-10-19/h3-6,14H,2,7-12H2,1H3,(H,18,20).
What are the key properties of 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide?
2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide has a molecular weight of 310.37 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(2-morpholin-4-ylethyl)butanamide is sourced from PubChem (CID 6498974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).