2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine

C9H18N2 — CID 118697091

IUPAC2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine
SMILESCC(C)N1CC2(CC(N)C2)C1
InChIInChI=1S/C9H18N2/c1-7(2)11-5-9(6-11)3-8(10)4-9/h7-8H,3-6,10H2,1-2H3
InChIKeyOMSZACNCQKWRDL-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.82
Rot. Bonds1

About 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine

2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine (PubChem CID 118697091) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine.

Molecular Properties

Compound Name2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine
PubChem CID118697091
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine
SMILESCC(C)N1CC2(CC(N)C2)C1
InChIInChI=1S/C9H18N2/c1-7(2)11-5-9(6-11)3-8(10)4-9/h7-8H,3-6,10H2,1-2H3
InChIKeyOMSZACNCQKWRDL-UHFFFAOYSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-propan-2-yl-2-azaspiro[3.3]heptan-6-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 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine?
The IUPAC name of 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine (CID 118697091) is 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine.
What is the SMILES notation for 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine?
The canonical SMILES for 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine is CC(C)N1CC2(CC(N)C2)C1.
What is the InChIKey of 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine?
The InChIKey is OMSZACNCQKWRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)11-5-9(6-11)3-8(10)4-9/h7-8H,3-6,10H2,1-2H3.
What are the key properties of 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine?
2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine has a molecular weight of 154.26 g/mol, XLogP of 0.82, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-2-azaspiro[3.3]heptan-6-amine is sourced from PubChem (CID 118697091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).