(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride

C6H14Cl2N2 — CID 23539486

IUPAC(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
SMILESCl.Cl.N[C@@H]1CNCC12CC2
InChIInChI=1S/C6H12N2.2ClH/c7-5-3-8-4-6(5)1-2-6;;/h5,8H,1-4,7H2;2*1H/t5-;;/m1../s1
InChIKeyYJMPDZLZEKRKFR-ZJIMSODOSA-N
MW185.10 g/mol
LogP0.54
Rot. Bonds

About (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride

(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride (PubChem CID 23539486) has the molecular formula C6H14Cl2N2 and a molecular weight of 185.10 g/mol. Its IUPAC name is (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride.

Molecular Properties

Compound Name(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
PubChem CID23539486
Molecular FormulaC6H14Cl2N2
Molecular Weight185.10 g/mol
Exact Mass184.05
IUPAC Name(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
SMILESCl.Cl.N[C@@H]1CNCC12CC2
InChIInChI=1S/C6H12N2.2ClH/c7-5-3-8-4-6(5)1-2-6;;/h5,8H,1-4,7H2;2*1H/t5-;;/m1../s1
InChIKeyYJMPDZLZEKRKFR-ZJIMSODOSA-N
XLogP0.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.10
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride 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 (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The IUPAC name of (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride (CID 23539486) is (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride.
What is the SMILES notation for (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The canonical SMILES for (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride is Cl.Cl.N[C@@H]1CNCC12CC2.
What is the InChIKey of (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The InChIKey is YJMPDZLZEKRKFR-ZJIMSODOSA-N. The full InChI is InChI=1S/C6H12N2.2ClH/c7-5-3-8-4-6(5)1-2-6;;/h5,8H,1-4,7H2;2*1H/t5-;;/m1../s1.
What are the key properties of (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
(7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride has a molecular weight of 185.10 g/mol, XLogP of 0.54, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-5-azaspiro[2.4]heptan-7-amine;dihydrochloride is sourced from PubChem (CID 23539486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).