8-azaspiro[4.5]decan-4-one;hydrochloride

C9H16ClNO — CID 18403965

IUPAC8-azaspiro[4.5]decan-4-one;hydrochloride
SMILESCl.O=C1CCCC12CCNCC2
InChIInChI=1S/C9H15NO.ClH/c11-8-2-1-3-9(8)4-6-10-7-5-9;/h10H,1-7H2;1H
InChIKeyNQDCEEJUEUKLRW-UHFFFAOYSA-N
MW189.69 g/mol
LogP1.53
Rot. Bonds

About 8-azaspiro[4.5]decan-4-one;hydrochloride

8-azaspiro[4.5]decan-4-one;hydrochloride (PubChem CID 18403965) has the molecular formula C9H16ClNO and a molecular weight of 189.69 g/mol. Its IUPAC name is 8-azaspiro[4.5]decan-4-one;hydrochloride.

Molecular Properties

Compound Name8-azaspiro[4.5]decan-4-one;hydrochloride
PubChem CID18403965
Molecular FormulaC9H16ClNO
Molecular Weight189.69 g/mol
Exact Mass189.09
IUPAC Name8-azaspiro[4.5]decan-4-one;hydrochloride
SMILESCl.O=C1CCCC12CCNCC2
InChIInChI=1S/C9H15NO.ClH/c11-8-2-1-3-9(8)4-6-10-7-5-9;/h10H,1-7H2;1H
InChIKeyNQDCEEJUEUKLRW-UHFFFAOYSA-N
XLogP1.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.69
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 8-azaspiro[4.5]decan-4-one;hydrochloride 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 8-azaspiro[4.5]decan-4-one;hydrochloride?
The IUPAC name of 8-azaspiro[4.5]decan-4-one;hydrochloride (CID 18403965) is 8-azaspiro[4.5]decan-4-one;hydrochloride.
What is the SMILES notation for 8-azaspiro[4.5]decan-4-one;hydrochloride?
The canonical SMILES for 8-azaspiro[4.5]decan-4-one;hydrochloride is Cl.O=C1CCCC12CCNCC2.
What is the InChIKey of 8-azaspiro[4.5]decan-4-one;hydrochloride?
The InChIKey is NQDCEEJUEUKLRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO.ClH/c11-8-2-1-3-9(8)4-6-10-7-5-9;/h10H,1-7H2;1H.
What are the key properties of 8-azaspiro[4.5]decan-4-one;hydrochloride?
8-azaspiro[4.5]decan-4-one;hydrochloride has a molecular weight of 189.69 g/mol, XLogP of 1.53, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-azaspiro[4.5]decan-4-one;hydrochloride is sourced from PubChem (CID 18403965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).