[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)

C7H8N3ORb — CID 170788982

IUPAC[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)
SMILESC[N-]Nc1ncccc1C=O.[Rb+]
InChIInChI=1S/C7H8N3O.Rb/c1-8-10-7-6(5-11)3-2-4-9-7;/h2-5H,1H3,(H,9,10,11);/q-1;+1
InChIKeyGZLMRLLRYVKDPQ-UHFFFAOYSA-N
MW235.63 g/mol
LogP-1.77
Rot. Bonds3

About [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)

[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+) (PubChem CID 170788982) has the molecular formula C7H8N3ORb and a molecular weight of 235.63 g/mol. Its IUPAC name is [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+).

Molecular Properties

Compound Name[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)
PubChem CID170788982
Molecular FormulaC7H8N3ORb
Molecular Weight235.63 g/mol
Exact Mass234.98
IUPAC Name[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)
SMILESC[N-]Nc1ncccc1C=O.[Rb+]
InChIInChI=1S/C7H8N3O.Rb/c1-8-10-7-6(5-11)3-2-4-9-7;/h2-5H,1H3,(H,9,10,11);/q-1;+1
InChIKeyGZLMRLLRYVKDPQ-UHFFFAOYSA-N
XLogP-1.77
TPSA56.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.63
LogP ≤ 5-1.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(ethylamino)pyridine-3-carbaldehyde
CID 15561922
2-fluoro-N-(3-formyl-2-pyridinyl)-5-(trifluoromethyl)benzamide
CID 173323900
3-formyl-N-methylpyridine-2-carboxamide
CID 89245626
2-(3-chloro-5-methoxyanilino)pyridine-3-carbaldehyde
CID 118011803
benzene-1,4-diamine;2-methylpyridine-3-carbaldehyde
CID 143052286
(3-formyl-2-pyridinyl)boronic acid
CID 130822828
N-(3-formyl-2-pyridinyl)-2-(3-methylthiophen-2-yl)acetamide
CID 54276812
2-pentoxypyridine-3-carbaldehyde
CID 11622489
2-aminosulfanylpyridine-3-carbaldehyde
CID 155744539
3-formylpyridine-2-sulfonic acid
CID 87563681
quinoline-5-carbaldehyde;hydrochloride
CID 174461977
2-[4-(1-imidazol-1-yl-2-methylpropyl)anilino]pyridine-3-carbaldehyde
CID 22603061

Frequently Asked Questions

What is the IUPAC name of [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)?
The IUPAC name of [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+) (CID 170788982) is [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+).
What is the SMILES notation for [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)?
The canonical SMILES for [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+) is C[N-]Nc1ncccc1C=O.[Rb+].
What is the InChIKey of [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)?
The InChIKey is GZLMRLLRYVKDPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3O.Rb/c1-8-10-7-6(5-11)3-2-4-9-7;/h2-5H,1H3,(H,9,10,11);/q-1;+1.
What are the key properties of [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+)?
[(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+) has a molecular weight of 235.63 g/mol, XLogP of -1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-formyl-2-pyridinyl)amino]-methylazanide;rubidium(1+) is sourced from PubChem (CID 170788982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).