4-(3-nitro-2-pyridinyl)morpholine

C9H11N3O3 — CID 2795439

IUPAC4-(3-nitro-2-pyridinyl)morpholine
SMILESO=[N+]([O-])c1cccnc1N1CCOCC1
InChIInChI=1S/C9H11N3O3/c13-12(14)8-2-1-3-10-9(8)11-4-6-15-7-5-11/h1-3H,4-7H2
InChIKeyQMINJWUSSJFQBR-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.83
Rot. Bonds2

About 4-(3-nitro-2-pyridinyl)morpholine

4-(3-nitro-2-pyridinyl)morpholine (PubChem CID 2795439) has the molecular formula C9H11N3O3 and a molecular weight of 209.20 g/mol. Its IUPAC name is 4-(3-nitro-2-pyridinyl)morpholine.

Molecular Properties

Compound Name4-(3-nitro-2-pyridinyl)morpholine
PubChem CID2795439
Molecular FormulaC9H11N3O3
Molecular Weight209.20 g/mol
Exact Mass209.08
IUPAC Name4-(3-nitro-2-pyridinyl)morpholine
SMILESO=[N+]([O-])c1cccnc1N1CCOCC1
InChIInChI=1S/C9H11N3O3/c13-12(14)8-2-1-3-10-9(8)11-4-6-15-7-5-11/h1-3H,4-7H2
InChIKeyQMINJWUSSJFQBR-UHFFFAOYSA-N
XLogP0.83
TPSA68.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-Nitropyridin-2-ylamine
CID 77887
2-Morpholino-5-nitropyridine
CID 96872
5-Nitro-2-piperidinopyridine
CID 97158
5-Nitro-N-phenylpyridin-2-amine
CID 81268
2-Amino-5-nitropyridine
CID 77888
1-(3-Nitropyridin-2-yl)piperidine-4-carboxamide
CID 2805612
1-(3-Nitropyridin-2-yl)piperazine
CID 3778834
N-methyl-5-nitropyridin-2-amine
CID 265883
N-Methyl-3-nitro-2-pyridinamine
CID 556349
N,N-dimethyl-N'-(5-nitropyridin-2-yl)benzene-1,4-diamine
CID 3146301
N,N,N'-trimethyl-N'-(3-nitro-2-pyridyl)hydrazonoformamide
CID 9583478
2,6-Dimethyl-4-(5-nitropyridin-2-yl)morpholine
CID 2803164

Frequently Asked Questions

What is the IUPAC name of 4-(3-nitro-2-pyridinyl)morpholine?
The IUPAC name of 4-(3-nitro-2-pyridinyl)morpholine (CID 2795439) is 4-(3-nitro-2-pyridinyl)morpholine.
What is the SMILES notation for 4-(3-nitro-2-pyridinyl)morpholine?
The canonical SMILES for 4-(3-nitro-2-pyridinyl)morpholine is O=[N+]([O-])c1cccnc1N1CCOCC1.
What is the InChIKey of 4-(3-nitro-2-pyridinyl)morpholine?
The InChIKey is QMINJWUSSJFQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c13-12(14)8-2-1-3-10-9(8)11-4-6-15-7-5-11/h1-3H,4-7H2.
What are the key properties of 4-(3-nitro-2-pyridinyl)morpholine?
4-(3-nitro-2-pyridinyl)morpholine has a molecular weight of 209.20 g/mol, XLogP of 0.83, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-nitro-2-pyridinyl)morpholine is sourced from PubChem (CID 2795439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).