N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide

C11H19N3O4 — CID 110872128

IUPACN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide
SMILESO=C(NCCN1CCCOC1=O)N1CCOCC1
InChIInChI=1S/C11H19N3O4/c15-10(13-5-8-17-9-6-13)12-2-4-14-3-1-7-18-11(14)16/h1-9H2,(H,12,15)
InChIKeyPMLSMBIEBUHALP-UHFFFAOYSA-N
MW257.29 g/mol
LogP-0.13
Rot. Bonds3

About N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide

N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide (PubChem CID 110872128) has the molecular formula C11H19N3O4 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide
PubChem CID110872128
Molecular FormulaC11H19N3O4
Molecular Weight257.29 g/mol
Exact Mass257.14
IUPAC NameN-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide
SMILESO=C(NCCN1CCCOC1=O)N1CCOCC1
InChIInChI=1S/C11H19N3O4/c15-10(13-5-8-17-9-6-13)12-2-4-14-3-1-7-18-11(14)16/h1-9H2,(H,12,15)
InChIKeyPMLSMBIEBUHALP-UHFFFAOYSA-N
XLogP-0.13
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide (CID 110872128) is N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide is O=C(NCCN1CCCOC1=O)N1CCOCC1.
What is the InChIKey of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is PMLSMBIEBUHALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4/c15-10(13-5-8-17-9-6-13)12-2-4-14-3-1-7-18-11(14)16/h1-9H2,(H,12,15).
What are the key properties of N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide?
N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 257.29 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-1,3-oxazinan-3-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 110872128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).