4-(5-nitro-6-phenyl-2-pyridinyl)morpholine

C15H15N3O3 — CID 133407232

IUPAC4-(5-nitro-6-phenyl-2-pyridinyl)morpholine
SMILESO=[N+]([O-])c1ccc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C15H15N3O3/c19-18(20)13-6-7-14(17-8-10-21-11-9-17)16-15(13)12-4-2-1-3-5-12/h1-7H,8-11H2
InChIKeyKFZNALOMDQFHGH-UHFFFAOYSA-N
MW285.30 g/mol
LogP2.49
Rot. Bonds3

About 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine

4-(5-nitro-6-phenyl-2-pyridinyl)morpholine (PubChem CID 133407232) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine.

Molecular Properties

Compound Name4-(5-nitro-6-phenyl-2-pyridinyl)morpholine
PubChem CID133407232
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name4-(5-nitro-6-phenyl-2-pyridinyl)morpholine
SMILESO=[N+]([O-])c1ccc(N2CCOCC2)nc1-c1ccccc1
InChIInChI=1S/C15H15N3O3/c19-18(20)13-6-7-14(17-8-10-21-11-9-17)16-15(13)12-4-2-1-3-5-12/h1-7H,8-11H2
InChIKeyKFZNALOMDQFHGH-UHFFFAOYSA-N
XLogP2.49
TPSA68.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 52.49
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

1-methyl-4-(5-nitro-6-phenyl-2-pyridinyl)piperazine
CID 133407191
4-(5-nitro-6-phenyl-2-pyridinyl)-1,4-thiazepane
CID 133409700
2-[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]acetamide
CID 133408202
N,N-dimethyl-4-(5-nitro-6-phenyl-2-pyridinyl)piperazine-1-carboxamide
CID 133409262
6-[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-3-nitro-2-phenylpyridine
CID 133409043
3-methyl-5-[[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]methyl]-1,2-oxazole
CID 133408182
[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]-(5-nitrothiophen-2-yl)methanone
CID 133409452
1,3-dimethyl-5-[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]pyrazol-4-amine
CID 133493134
2-[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]-N-phenylacetamide
CID 133408645
4-[2-[(5-nitro-6-phenyl-2-pyridinyl)sulfanyl]ethyl]morpholine
CID 133408465
(4-methoxyphenyl)-[4-(5-nitro-6-phenyl-2-pyridinyl)piperazin-1-yl]methanone
CID 133408833
1-[(5-chloro-2-pyridinyl)methyl]-4-(5-nitro-6-phenyl-2-pyridinyl)piperazine
CID 133465658

Frequently Asked Questions

What is the IUPAC name of 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine?
The IUPAC name of 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine (CID 133407232) is 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine.
What is the SMILES notation for 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine?
The canonical SMILES for 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine is O=[N+]([O-])c1ccc(N2CCOCC2)nc1-c1ccccc1.
What is the InChIKey of 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine?
The InChIKey is KFZNALOMDQFHGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c19-18(20)13-6-7-14(17-8-10-21-11-9-17)16-15(13)12-4-2-1-3-5-12/h1-7H,8-11H2.
What are the key properties of 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine?
4-(5-nitro-6-phenyl-2-pyridinyl)morpholine has a molecular weight of 285.30 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-nitro-6-phenyl-2-pyridinyl)morpholine is sourced from PubChem (CID 133407232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).