1-azaspiro[4.5]decane;hydrochloride

C9H18ClN — CID 18780563

IUPAC1-azaspiro[4.5]decane;hydrochloride
SMILESC1CCC2(CC1)CCCN2.Cl
InChIInChI=1S/C9H17N.ClH/c1-2-5-9(6-3-1)7-4-8-10-9;/h10H,1-8H2;1H
InChIKeyKWMBQJLMRFYETK-UHFFFAOYSA-N
MW175.70 g/mol
LogP2.49
Rot. Bonds

About 1-azaspiro[4.5]decane;hydrochloride

1-azaspiro[4.5]decane;hydrochloride (PubChem CID 18780563) has the molecular formula C9H18ClN and a molecular weight of 175.70 g/mol. Its IUPAC name is 1-azaspiro[4.5]decane;hydrochloride.

Molecular Properties

Compound Name1-azaspiro[4.5]decane;hydrochloride
PubChem CID18780563
Molecular FormulaC9H18ClN
Molecular Weight175.70 g/mol
Exact Mass175.11
IUPAC Name1-azaspiro[4.5]decane;hydrochloride
SMILESC1CCC2(CC1)CCCN2.Cl
InChIInChI=1S/C9H17N.ClH/c1-2-5-9(6-3-1)7-4-8-10-9;/h10H,1-8H2;1H
InChIKeyKWMBQJLMRFYETK-UHFFFAOYSA-N
XLogP2.49
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.70
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-azaspiro[4.5]decane;hydrochloride?
The IUPAC name of 1-azaspiro[4.5]decane;hydrochloride (CID 18780563) is 1-azaspiro[4.5]decane;hydrochloride.
What is the SMILES notation for 1-azaspiro[4.5]decane;hydrochloride?
The canonical SMILES for 1-azaspiro[4.5]decane;hydrochloride is C1CCC2(CC1)CCCN2.Cl.
What is the InChIKey of 1-azaspiro[4.5]decane;hydrochloride?
The InChIKey is KWMBQJLMRFYETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N.ClH/c1-2-5-9(6-3-1)7-4-8-10-9;/h10H,1-8H2;1H.
What are the key properties of 1-azaspiro[4.5]decane;hydrochloride?
1-azaspiro[4.5]decane;hydrochloride has a molecular weight of 175.70 g/mol, XLogP of 2.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azaspiro[4.5]decane;hydrochloride is sourced from PubChem (CID 18780563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).