2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine

C9H19N3 — CID 128922534

IUPAC2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
SMILESNCCN1CCC2(CCNC2)C1
InChIInChI=1S/C9H19N3/c10-3-6-12-5-2-9(8-12)1-4-11-7-9/h11H,1-8,10H2
InChIKeySVQZFZFGFGZUPU-UHFFFAOYSA-N
MW169.27 g/mol
LogP-0.37
Rot. Bonds2

About 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine

2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine (PubChem CID 128922534) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
PubChem CID128922534
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
SMILESNCCN1CCC2(CCNC2)C1
InChIInChI=1S/C9H19N3/c10-3-6-12-5-2-9(8-12)1-4-11-7-9/h11H,1-8,10H2
InChIKeySVQZFZFGFGZUPU-UHFFFAOYSA-N
XLogP-0.37
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine?
The IUPAC name of 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine (CID 128922534) is 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine.
What is the SMILES notation for 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine?
The canonical SMILES for 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine is NCCN1CCC2(CCNC2)C1.
What is the InChIKey of 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine?
The InChIKey is SVQZFZFGFGZUPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3/c10-3-6-12-5-2-9(8-12)1-4-11-7-9/h11H,1-8,10H2.
What are the key properties of 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine?
2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine has a molecular weight of 169.27 g/mol, XLogP of -0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine is sourced from PubChem (CID 128922534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).