ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine

C10H23N3 — CID 169133295

IUPACethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine
SMILESCC.CN1CCCC2(C1)CN(N)C2
InChIInChI=1S/C8H17N3.C2H6/c1-10-4-2-3-8(5-10)6-11(9)7-8;1-2/h2-7,9H2,1H3;1-2H3
InChIKeyMCHFLLFWJOQBBW-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.91
Rot. Bonds

About ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine

ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine (PubChem CID 169133295) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine.

Molecular Properties

Compound Nameethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine
PubChem CID169133295
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Nameethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine
SMILESCC.CN1CCCC2(C1)CN(N)C2
InChIInChI=1S/C8H17N3.C2H6/c1-10-4-2-3-8(5-10)6-11(9)7-8;1-2/h2-7,9H2,1H3;1-2H3
InChIKeyMCHFLLFWJOQBBW-UHFFFAOYSA-N
XLogP0.91
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine?
The IUPAC name of ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine (CID 169133295) is ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine.
What is the SMILES notation for ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine?
The canonical SMILES for ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine is CC.CN1CCCC2(C1)CN(N)C2.
What is the InChIKey of ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine?
The InChIKey is MCHFLLFWJOQBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3.C2H6/c1-10-4-2-3-8(5-10)6-11(9)7-8;1-2/h2-7,9H2,1H3;1-2H3.
What are the key properties of ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine?
ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 0.91, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;8-methyl-2,8-diazaspiro[3.5]nonan-2-amine is sourced from PubChem (CID 169133295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).