2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one

C11H13N3O3 — CID 116990411

IUPAC2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESO=C1Nc2ncccc2OC1C1CNCCO1
InChIInChI=1S/C11H13N3O3/c15-11-9(8-6-12-4-5-16-8)17-7-2-1-3-13-10(7)14-11/h1-3,8-9,12H,4-6H2,(H,13,14,15)
InChIKeyYJDVJZZHGHJAPE-UHFFFAOYSA-N
MW235.24 g/mol
LogP-0.23
Rot. Bonds1

About 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one

2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one (PubChem CID 116990411) has the molecular formula C11H13N3O3 and a molecular weight of 235.24 g/mol. Its IUPAC name is 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one.

Molecular Properties

Compound Name2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
PubChem CID116990411
Molecular FormulaC11H13N3O3
Molecular Weight235.24 g/mol
Exact Mass235.10
IUPAC Name2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one
SMILESO=C1Nc2ncccc2OC1C1CNCCO1
InChIInChI=1S/C11H13N3O3/c15-11-9(8-6-12-4-5-16-8)17-7-2-1-3-13-10(7)14-11/h1-3,8-9,12H,4-6H2,(H,13,14,15)
InChIKeyYJDVJZZHGHJAPE-UHFFFAOYSA-N
XLogP-0.23
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-iodo-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 91884397
2-ethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 13087443
3-oxo-4H-pyrido[3,2-b][1,4]oxazine-2-carboxylic acid
CID 22036235
2-acetyl-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 116990407
2-[(1-methylpiperazin-2-yl)methyl]-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 116990418
3-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)oxetane-3-carboxylic acid
CID 116990440
2-(2-aminoethyl)-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 116990341
2-(2-chloroethyl)-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 3644169
2-(2-morpholin-4-ylethyl)-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 2766172
2-(3-amino-3-methylbutyl)-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 116990354
2-methyl-2-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)propanenitrile
CID 116990406
3-methyl-2-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)butanenitrile
CID 116990454

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The IUPAC name of 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one (CID 116990411) is 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one.
What is the SMILES notation for 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The canonical SMILES for 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one is O=C1Nc2ncccc2OC1C1CNCCO1.
What is the InChIKey of 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
The InChIKey is YJDVJZZHGHJAPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O3/c15-11-9(8-6-12-4-5-16-8)17-7-2-1-3-13-10(7)14-11/h1-3,8-9,12H,4-6H2,(H,13,14,15).
What are the key properties of 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one?
2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one has a molecular weight of 235.24 g/mol, XLogP of -0.23, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-4H-pyrido[3,2-b][1,4]oxazin-3-one is sourced from PubChem (CID 116990411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).