8-azaspiro[4.5]decan-4-amine;dihydrochloride

C9H20Cl2N2 — CID 138106142

IUPAC8-azaspiro[4.5]decan-4-amine;dihydrochloride
SMILESCl.Cl.NC1CCCC12CCNCC2
InChIInChI=1S/C9H18N2.2ClH/c10-8-2-1-3-9(8)4-6-11-7-5-9;;/h8,11H,1-7,10H2;2*1H
InChIKeyJJCPBBVNLLUUJU-UHFFFAOYSA-N
MW227.18 g/mol
LogP1.71
Rot. Bonds

About 8-azaspiro[4.5]decan-4-amine;dihydrochloride

8-azaspiro[4.5]decan-4-amine;dihydrochloride (PubChem CID 138106142) has the molecular formula C9H20Cl2N2 and a molecular weight of 227.18 g/mol. Its IUPAC name is 8-azaspiro[4.5]decan-4-amine;dihydrochloride.

Molecular Properties

Compound Name8-azaspiro[4.5]decan-4-amine;dihydrochloride
PubChem CID138106142
Molecular FormulaC9H20Cl2N2
Molecular Weight227.18 g/mol
Exact Mass226.10
IUPAC Name8-azaspiro[4.5]decan-4-amine;dihydrochloride
SMILESCl.Cl.NC1CCCC12CCNCC2
InChIInChI=1S/C9H18N2.2ClH/c10-8-2-1-3-9(8)4-6-11-7-5-9;;/h8,11H,1-7,10H2;2*1H
InChIKeyJJCPBBVNLLUUJU-UHFFFAOYSA-N
XLogP1.71
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.18
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-Azaspiro[4.5]decane
CID 14448981
8-Azaspiro(4.5)decane hydrochloride
CID 22401229
7-Azaspiro(3.5)nonan-2-amine dihydrochloride
CID 139465152
8-Azaspiro(4.5)decane
CID 437152
(4R)-3-fluoro-8-methyl-8-azaspiro[4.5]decan-4-amine
CID 118247709
(4S)-2-fluoro-8-methyl-8-azaspiro[4.5]decan-4-amine
CID 118247716
(R)-3,3-Difluoro-8-azaspiro[4.5]decan-1-amine
CID 124146313
(4S)-3-fluoro-8-azaspiro[4.5]decan-4-amine
CID 124146522
(1R,3S)-3-Fluoro-8-azaspiro[4.5]decan-1-amine
CID 124146523
(1R,3R)-3-Fluoro-8-azaspiro[4.5]decan-1-amine
CID 124146524
3,3-Difluoro-8-azaspiro[4.5]decan-1-amine
CID 124147970
(4R)-8-ethyl-3-fluoro-8-azaspiro[4.5]decan-4-amine
CID 126480858

Frequently Asked Questions

What is the IUPAC name of 8-azaspiro[4.5]decan-4-amine;dihydrochloride?
The IUPAC name of 8-azaspiro[4.5]decan-4-amine;dihydrochloride (CID 138106142) is 8-azaspiro[4.5]decan-4-amine;dihydrochloride.
What is the SMILES notation for 8-azaspiro[4.5]decan-4-amine;dihydrochloride?
The canonical SMILES for 8-azaspiro[4.5]decan-4-amine;dihydrochloride is Cl.Cl.NC1CCCC12CCNCC2.
What is the InChIKey of 8-azaspiro[4.5]decan-4-amine;dihydrochloride?
The InChIKey is JJCPBBVNLLUUJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2.2ClH/c10-8-2-1-3-9(8)4-6-11-7-5-9;;/h8,11H,1-7,10H2;2*1H.
What are the key properties of 8-azaspiro[4.5]decan-4-amine;dihydrochloride?
8-azaspiro[4.5]decan-4-amine;dihydrochloride has a molecular weight of 227.18 g/mol, XLogP of 1.71, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[4.5]decan-4-amine;dihydrochloride is sourced from PubChem (CID 138106142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).