3-methyl-3,10-diazaspiro[5.6]dodecan-9-one

C11H20N2O — CID 135257115

IUPAC3-methyl-3,10-diazaspiro[5.6]dodecan-9-one
SMILESCN1CCC2(CCNC(=O)CC2)CC1
InChIInChI=1S/C11H20N2O/c1-13-8-5-11(6-9-13)3-2-10(14)12-7-4-11/h2-9H2,1H3,(H,12,14)
InChIKeyHGKPPQMYPIESJM-UHFFFAOYSA-N
MW196.29 g/mol
LogP1.00
Rot. Bonds

About 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one

3-methyl-3,10-diazaspiro[5.6]dodecan-9-one (PubChem CID 135257115) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one.

Molecular Properties

Compound Name3-methyl-3,10-diazaspiro[5.6]dodecan-9-one
PubChem CID135257115
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name3-methyl-3,10-diazaspiro[5.6]dodecan-9-one
SMILESCN1CCC2(CCNC(=O)CC2)CC1
InChIInChI=1S/C11H20N2O/c1-13-8-5-11(6-9-13)3-2-10(14)12-7-4-11/h2-9H2,1H3,(H,12,14)
InChIKeyHGKPPQMYPIESJM-UHFFFAOYSA-N
XLogP1.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one?
The IUPAC name of 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one (CID 135257115) is 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one.
What is the SMILES notation for 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one?
The canonical SMILES for 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one is CN1CCC2(CCNC(=O)CC2)CC1.
What is the InChIKey of 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one?
The InChIKey is HGKPPQMYPIESJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-13-8-5-11(6-9-13)3-2-10(14)12-7-4-11/h2-9H2,1H3,(H,12,14).
What are the key properties of 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one?
3-methyl-3,10-diazaspiro[5.6]dodecan-9-one has a molecular weight of 196.29 g/mol, XLogP of 1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3,10-diazaspiro[5.6]dodecan-9-one is sourced from PubChem (CID 135257115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).