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

C9H16ClNO — CID 127263730

IUPAC2-azaspiro[4.5]decan-8-one;hydrochloride
SMILESCl.O=C1CCC2(CCNC2)CC1
InChIInChI=1S/C9H15NO.ClH/c11-8-1-3-9(4-2-8)5-6-10-7-9;/h10H,1-7H2;1H
InChIKeyDNMSSWJZFXSHQX-UHFFFAOYSA-N
MW189.69 g/mol
LogP1.53
Rot. Bonds

About 2-azaspiro[4.5]decan-8-one;hydrochloride

2-azaspiro[4.5]decan-8-one;hydrochloride (PubChem CID 127263730) has the molecular formula C9H16ClNO and a molecular weight of 189.69 g/mol. Its IUPAC name is 2-azaspiro[4.5]decan-8-one;hydrochloride.

Molecular Properties

Compound Name2-azaspiro[4.5]decan-8-one;hydrochloride
PubChem CID127263730
Molecular FormulaC9H16ClNO
Molecular Weight189.69 g/mol
Exact Mass189.09
IUPAC Name2-azaspiro[4.5]decan-8-one;hydrochloride
SMILESCl.O=C1CCC2(CCNC2)CC1
InChIInChI=1S/C9H15NO.ClH/c11-8-1-3-9(4-2-8)5-6-10-7-9;/h10H,1-7H2;1H
InChIKeyDNMSSWJZFXSHQX-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

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.5]decan-8-one;hydrochloride?
The IUPAC name of 2-azaspiro[4.5]decan-8-one;hydrochloride (CID 127263730) is 2-azaspiro[4.5]decan-8-one;hydrochloride.
What is the SMILES notation for 2-azaspiro[4.5]decan-8-one;hydrochloride?
The canonical SMILES for 2-azaspiro[4.5]decan-8-one;hydrochloride is Cl.O=C1CCC2(CCNC2)CC1.
What is the InChIKey of 2-azaspiro[4.5]decan-8-one;hydrochloride?
The InChIKey is DNMSSWJZFXSHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO.ClH/c11-8-1-3-9(4-2-8)5-6-10-7-9;/h10H,1-7H2;1H.
What are the key properties of 2-azaspiro[4.5]decan-8-one;hydrochloride?
2-azaspiro[4.5]decan-8-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 2-azaspiro[4.5]decan-8-one;hydrochloride is sourced from PubChem (CID 127263730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).