4-(5-azido-2-pyridinyl)morpholin-3-one

C9H9N5O2 — CID 130229143

IUPAC4-(5-azido-2-pyridinyl)morpholin-3-one
SMILES[N-]=[N+]=Nc1ccc(N2CCOCC2=O)nc1
InChIInChI=1S/C9H9N5O2/c10-13-12-7-1-2-8(11-5-7)14-3-4-16-6-9(14)15/h1-2,5H,3-4,6H2
InChIKeyKOVQQUXWPNYJDX-UHFFFAOYSA-N
MW219.20 g/mol
LogP1.39
Rot. Bonds2

About 4-(5-azido-2-pyridinyl)morpholin-3-one

4-(5-azido-2-pyridinyl)morpholin-3-one (PubChem CID 130229143) has the molecular formula C9H9N5O2 and a molecular weight of 219.20 g/mol. Its IUPAC name is 4-(5-azido-2-pyridinyl)morpholin-3-one.

Molecular Properties

Compound Name4-(5-azido-2-pyridinyl)morpholin-3-one
PubChem CID130229143
Molecular FormulaC9H9N5O2
Molecular Weight219.20 g/mol
Exact Mass219.08
IUPAC Name4-(5-azido-2-pyridinyl)morpholin-3-one
SMILES[N-]=[N+]=Nc1ccc(N2CCOCC2=O)nc1
InChIInChI=1S/C9H9N5O2/c10-13-12-7-1-2-8(11-5-7)14-3-4-16-6-9(14)15/h1-2,5H,3-4,6H2
InChIKeyKOVQQUXWPNYJDX-UHFFFAOYSA-N
XLogP1.39
TPSA91.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

4-[6-[3-[hydroxy(sulfino)amino]-2-oxopyrrolidin-1-yl]-3-pyridinyl]-3-oxomorpholine
CID 142892045
4-(3-oxomorpholin-4-yl)benzoyl azide
CID 72950117
(3R,3aS)-3-(hydroxymethyl)-7-[6-(3-oxomorpholin-4-yl)-3-pyridinyl]-3a,4-dihydro-3H-[1,3]oxazolo[4,3-c][1,4]benzoxazin-1-one
CID 71601380
[3-fluoro-4-(3-oxomorpholin-4-yl)phenyl]imino-iminoazanium
CID 137439146
5-bromo-N-[(3R)-5-oxo-1-[5-(3-oxomorpholin-4-yl)-2-pyridinyl]pyrrolidin-3-yl]thiophene-2-carboxamide
CID 11568908
4-(5-isothiocyanato-2-pyridinyl)morpholine
CID 2776464
4-[5-[4-[3-(5-chlorothiophen-2-yl)-3-oxopropyl]triazol-1-yl]-2-pyridinyl]morpholin-3-one
CID 158804843
4-(4-ethynylphenyl)morpholin-3-one
CID 119094616
7,16-diphenyl-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane-6,17-dione
CID 12887277
methyl 3-azido-6-bromo-2-(6-morpholin-4-yl-3-pyridinyl)pyridine-4-carboxylate
CID 86663023
2-amino-5-(3-oxomorpholin-4-yl)pyridine-3-carbonitrile
CID 91756494
4-(2-amino-5-bromo-3-pyridinyl)morpholin-3-one
CID 90078115

Frequently Asked Questions

What is the IUPAC name of 4-(5-azido-2-pyridinyl)morpholin-3-one?
The IUPAC name of 4-(5-azido-2-pyridinyl)morpholin-3-one (CID 130229143) is 4-(5-azido-2-pyridinyl)morpholin-3-one.
What is the SMILES notation for 4-(5-azido-2-pyridinyl)morpholin-3-one?
The canonical SMILES for 4-(5-azido-2-pyridinyl)morpholin-3-one is [N-]=[N+]=Nc1ccc(N2CCOCC2=O)nc1.
What is the InChIKey of 4-(5-azido-2-pyridinyl)morpholin-3-one?
The InChIKey is KOVQQUXWPNYJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O2/c10-13-12-7-1-2-8(11-5-7)14-3-4-16-6-9(14)15/h1-2,5H,3-4,6H2.
What are the key properties of 4-(5-azido-2-pyridinyl)morpholin-3-one?
4-(5-azido-2-pyridinyl)morpholin-3-one has a molecular weight of 219.20 g/mol, XLogP of 1.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-azido-2-pyridinyl)morpholin-3-one is sourced from PubChem (CID 130229143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).