2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine

C13H20N4 — CID 167351319

IUPAC2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine
SMILESCN(C)C1CC2(C1)CN(c1ccc(N)nc1)C2
InChIInChI=1S/C13H20N4/c1-16(2)11-5-13(6-11)8-17(9-13)10-3-4-12(14)15-7-10/h3-4,7,11H,5-6,8-9H2,1-2H3,(H2,14,15)
InChIKeyRWYGCZKTDJLZPV-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.19
Rot. Bonds2

About 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine

2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine (PubChem CID 167351319) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine.

Molecular Properties

Compound Name2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine
PubChem CID167351319
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC Name2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine
SMILESCN(C)C1CC2(C1)CN(c1ccc(N)nc1)C2
InChIInChI=1S/C13H20N4/c1-16(2)11-5-13(6-11)8-17(9-13)10-3-4-12(14)15-7-10/h3-4,7,11H,5-6,8-9H2,1-2H3,(H2,14,15)
InChIKeyRWYGCZKTDJLZPV-UHFFFAOYSA-N
XLogP1.19
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine?
The IUPAC name of 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine (CID 167351319) is 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine.
What is the SMILES notation for 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine?
The canonical SMILES for 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine is CN(C)C1CC2(C1)CN(c1ccc(N)nc1)C2.
What is the InChIKey of 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine?
The InChIKey is RWYGCZKTDJLZPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-16(2)11-5-13(6-11)8-17(9-13)10-3-4-12(14)15-7-10/h3-4,7,11H,5-6,8-9H2,1-2H3,(H2,14,15).
What are the key properties of 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine?
2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine has a molecular weight of 232.33 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-3-pyridinyl)-N,N-dimethyl-2-azaspiro[3.3]heptan-6-amine is sourced from PubChem (CID 167351319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).