5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide

C15H20N4O — CID 155230407

IUPAC5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(OC2CC3(C2)CN(C2CC2)C3)cn1
InChIInChI=1S/C15H20N4O/c16-14(17)13-4-3-11(7-18-13)20-12-5-15(6-12)8-19(9-15)10-1-2-10/h3-4,7,10,12H,1-2,5-6,8-9H2,(H3,16,17)
InChIKeyLTDZAERBWAUZBD-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.37
Rot. Bonds4

About 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide

5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide (PubChem CID 155230407) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide.

Molecular Properties

Compound Name5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide
PubChem CID155230407
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(OC2CC3(C2)CN(C2CC2)C3)cn1
InChIInChI=1S/C15H20N4O/c16-14(17)13-4-3-11(7-18-13)20-12-5-15(6-12)8-19(9-15)10-1-2-10/h3-4,7,10,12H,1-2,5-6,8-9H2,(H3,16,17)
InChIKeyLTDZAERBWAUZBD-UHFFFAOYSA-N
XLogP1.37
TPSA75.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide?
The IUPAC name of 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide (CID 155230407) is 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide.
What is the SMILES notation for 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide?
The canonical SMILES for 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(OC2CC3(C2)CN(C2CC2)C3)cn1.
What is the InChIKey of 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide?
The InChIKey is LTDZAERBWAUZBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-14(17)13-4-3-11(7-18-13)20-12-5-15(6-12)8-19(9-15)10-1-2-10/h3-4,7,10,12H,1-2,5-6,8-9H2,(H3,16,17).
What are the key properties of 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide?
5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide has a molecular weight of 272.35 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-cyclopropyl-2-azaspiro[3.3]heptan-6-yl)oxy]pyridine-2-carboximidamide is sourced from PubChem (CID 155230407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).