N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide

C17H21FN2O3 — CID 71922891

IUPACN-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide
SMILESO=C(CN1CCCOC1=O)NC1CCCC1c1ccc(F)cc1
InChIInChI=1S/C17H21FN2O3/c18-13-7-5-12(6-8-13)14-3-1-4-15(14)19-16(21)11-20-9-2-10-23-17(20)22/h5-8,14-15H,1-4,9-11H2,(H,19,21)
InChIKeyQKQLCYULQUCEDX-UHFFFAOYSA-N
MW320.36 g/mol
LogP2.42
Rot. Bonds4

About N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide

N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide (PubChem CID 71922891) has the molecular formula C17H21FN2O3 and a molecular weight of 320.36 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide
PubChem CID71922891
Molecular FormulaC17H21FN2O3
Molecular Weight320.36 g/mol
Exact Mass320.15
IUPAC NameN-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide
SMILESO=C(CN1CCCOC1=O)NC1CCCC1c1ccc(F)cc1
InChIInChI=1S/C17H21FN2O3/c18-13-7-5-12(6-8-13)14-3-1-4-15(14)19-16(21)11-20-9-2-10-23-17(20)22/h5-8,14-15H,1-4,9-11H2,(H,19,21)
InChIKeyQKQLCYULQUCEDX-UHFFFAOYSA-N
XLogP2.42
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.36
LogP ≤ 52.42
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)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide?
The IUPAC name of N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide (CID 71922891) is N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide is O=C(CN1CCCOC1=O)NC1CCCC1c1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide?
The InChIKey is QKQLCYULQUCEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O3/c18-13-7-5-12(6-8-13)14-3-1-4-15(14)19-16(21)11-20-9-2-10-23-17(20)22/h5-8,14-15H,1-4,9-11H2,(H,19,21).
What are the key properties of N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide?
N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide has a molecular weight of 320.36 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)cyclopentyl]-2-(2-oxo-1,3-oxazinan-3-yl)acetamide is sourced from PubChem (CID 71922891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).