6-azaspiro[3.5]nonan-9-one;hydrochloride

C8H14ClNO — CID 134211693

IUPAC6-azaspiro[3.5]nonan-9-one;hydrochloride
SMILESCl.O=C1CCNCC12CCC2
InChIInChI=1S/C8H13NO.ClH/c10-7-2-5-9-6-8(7)3-1-4-8;/h9H,1-6H2;1H
InChIKeyRATJFDLHHOWZBQ-UHFFFAOYSA-N
MW175.66 g/mol
LogP1.14
Rot. Bonds

About 6-azaspiro[3.5]nonan-9-one;hydrochloride

6-azaspiro[3.5]nonan-9-one;hydrochloride (PubChem CID 134211693) has the molecular formula C8H14ClNO and a molecular weight of 175.66 g/mol. Its IUPAC name is 6-azaspiro[3.5]nonan-9-one;hydrochloride.

Molecular Properties

Compound Name6-azaspiro[3.5]nonan-9-one;hydrochloride
PubChem CID134211693
Molecular FormulaC8H14ClNO
Molecular Weight175.66 g/mol
Exact Mass175.08
IUPAC Name6-azaspiro[3.5]nonan-9-one;hydrochloride
SMILESCl.O=C1CCNCC12CCC2
InChIInChI=1S/C8H13NO.ClH/c10-7-2-5-9-6-8(7)3-1-4-8;/h9H,1-6H2;1H
InChIKeyRATJFDLHHOWZBQ-UHFFFAOYSA-N
XLogP1.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.66
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-azaspiro[3.5]nonan-9-one;hydrochloride?
The IUPAC name of 6-azaspiro[3.5]nonan-9-one;hydrochloride (CID 134211693) is 6-azaspiro[3.5]nonan-9-one;hydrochloride.
What is the SMILES notation for 6-azaspiro[3.5]nonan-9-one;hydrochloride?
The canonical SMILES for 6-azaspiro[3.5]nonan-9-one;hydrochloride is Cl.O=C1CCNCC12CCC2.
What is the InChIKey of 6-azaspiro[3.5]nonan-9-one;hydrochloride?
The InChIKey is RATJFDLHHOWZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO.ClH/c10-7-2-5-9-6-8(7)3-1-4-8;/h9H,1-6H2;1H.
What are the key properties of 6-azaspiro[3.5]nonan-9-one;hydrochloride?
6-azaspiro[3.5]nonan-9-one;hydrochloride has a molecular weight of 175.66 g/mol, XLogP of 1.14, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-azaspiro[3.5]nonan-9-one;hydrochloride is sourced from PubChem (CID 134211693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).