2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide

C15H19FN2O3 — CID 35425223

IUPAC2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide
SMILESO=C(CN1CCC2(CC1)OCCO2)Nc1cccc(F)c1
InChIInChI=1S/C15H19FN2O3/c16-12-2-1-3-13(10-12)17-14(19)11-18-6-4-15(5-7-18)20-8-9-21-15/h1-3,10H,4-9,11H2,(H,17,19)
InChIKeyBKNZEYXJXQMILY-UHFFFAOYSA-N
MW294.33 g/mol
LogP1.60
Rot. Bonds3

About 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide

2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide (PubChem CID 35425223) has the molecular formula C15H19FN2O3 and a molecular weight of 294.33 g/mol. Its IUPAC name is 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide
PubChem CID35425223
Molecular FormulaC15H19FN2O3
Molecular Weight294.33 g/mol
Exact Mass294.14
IUPAC Name2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide
SMILESO=C(CN1CCC2(CC1)OCCO2)Nc1cccc(F)c1
InChIInChI=1S/C15H19FN2O3/c16-12-2-1-3-13(10-12)17-14(19)11-18-6-4-15(5-7-18)20-8-9-21-15/h1-3,10H,4-9,11H2,(H,17,19)
InChIKeyBKNZEYXJXQMILY-UHFFFAOYSA-N
XLogP1.60
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide (CID 35425223) is 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide is O=C(CN1CCC2(CC1)OCCO2)Nc1cccc(F)c1.
What is the InChIKey of 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide?
The InChIKey is BKNZEYXJXQMILY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O3/c16-12-2-1-3-13(10-12)17-14(19)11-18-6-4-15(5-7-18)20-8-9-21-15/h1-3,10H,4-9,11H2,(H,17,19).
What are the key properties of 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide?
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide has a molecular weight of 294.33 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 35425223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).