7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride

C9H17ClN2O — CID 75481667

IUPAC7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride
SMILESCN1CCCC2(CCNC2)C1=O.Cl
InChIInChI=1S/C9H16N2O.ClH/c1-11-6-2-3-9(8(11)12)4-5-10-7-9;/h10H,2-7H2,1H3;1H
InChIKeyZFYMMJUDJUPSJG-UHFFFAOYSA-N
MW204.70 g/mol
LogP0.64
Rot. Bonds

About 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride

7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride (PubChem CID 75481667) has the molecular formula C9H17ClN2O and a molecular weight of 204.70 g/mol. Its IUPAC name is 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride.

Molecular Properties

Compound Name7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride
PubChem CID75481667
Molecular FormulaC9H17ClN2O
Molecular Weight204.70 g/mol
Exact Mass204.10
IUPAC Name7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride
SMILESCN1CCCC2(CCNC2)C1=O.Cl
InChIInChI=1S/C9H16N2O.ClH/c1-11-6-2-3-9(8(11)12)4-5-10-7-9;/h10H,2-7H2,1H3;1H
InChIKeyZFYMMJUDJUPSJG-UHFFFAOYSA-N
XLogP0.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.70
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride?
The IUPAC name of 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride (CID 75481667) is 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride.
What is the SMILES notation for 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride?
The canonical SMILES for 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride is CN1CCCC2(CCNC2)C1=O.Cl.
What is the InChIKey of 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride?
The InChIKey is ZFYMMJUDJUPSJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O.ClH/c1-11-6-2-3-9(8(11)12)4-5-10-7-9;/h10H,2-7H2,1H3;1H.
What are the key properties of 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride?
7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride has a molecular weight of 204.70 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2,7-diazaspiro[4.5]decan-6-one;hydrochloride is sourced from PubChem (CID 75481667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).