5,9-dimethyl-3-azaspiro[5.5]undecane

C12H23N — CID 79320887

IUPAC5,9-dimethyl-3-azaspiro[5.5]undecane
SMILESCC1CCC2(CCNCC2C)CC1
InChIInChI=1S/C12H23N/c1-10-3-5-12(6-4-10)7-8-13-9-11(12)2/h10-11,13H,3-9H2,1-2H3
InChIKeyHCZWEWPHZADMCU-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.81
Rot. Bonds

About 5,9-dimethyl-3-azaspiro[5.5]undecane

5,9-dimethyl-3-azaspiro[5.5]undecane (PubChem CID 79320887) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 5,9-dimethyl-3-azaspiro[5.5]undecane.

Molecular Properties

Compound Name5,9-dimethyl-3-azaspiro[5.5]undecane
PubChem CID79320887
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name5,9-dimethyl-3-azaspiro[5.5]undecane
SMILESCC1CCC2(CCNCC2C)CC1
InChIInChI=1S/C12H23N/c1-10-3-5-12(6-4-10)7-8-13-9-11(12)2/h10-11,13H,3-9H2,1-2H3
InChIKeyHCZWEWPHZADMCU-UHFFFAOYSA-N
XLogP2.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 79321561
6-methyl-2,8-diazaspiro[4.5]decane
CID 83680090
5,9,9-trimethyl-3-azaspiro[5.6]dodecane
CID 79321563
9-methyl-5-(2-methylpropyl)-3-azaspiro[5.6]dodecane
CID 79320901
11-methyl-2-thia-9-azaspiro[5.5]undecane
CID 79320397
N,N,11-trimethyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 83265788
(3R)-3,4-dimethylpiperidin-4-ol
CID 153404832
5-(2-fluorophenyl)-9-methyl-3-azaspiro[5.6]dodecane
CID 79454886
4-ethyl-11-methyl-3-oxa-9-azaspiro[5.5]undecane
CID 79321378
2-methyl-5-azaspiro[2.4]heptane
CID 91206231
4-cyclopropyl-4-ethyl-3-methylpiperidine
CID 79320206
9-tert-butyl-5-cyclopentyl-3-azaspiro[5.5]undecane
CID 115927129

Frequently Asked Questions

What is the IUPAC name of 5,9-dimethyl-3-azaspiro[5.5]undecane?
The IUPAC name of 5,9-dimethyl-3-azaspiro[5.5]undecane (CID 79320887) is 5,9-dimethyl-3-azaspiro[5.5]undecane.
What is the SMILES notation for 5,9-dimethyl-3-azaspiro[5.5]undecane?
The canonical SMILES for 5,9-dimethyl-3-azaspiro[5.5]undecane is CC1CCC2(CCNCC2C)CC1.
What is the InChIKey of 5,9-dimethyl-3-azaspiro[5.5]undecane?
The InChIKey is HCZWEWPHZADMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10-3-5-12(6-4-10)7-8-13-9-11(12)2/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 5,9-dimethyl-3-azaspiro[5.5]undecane?
5,9-dimethyl-3-azaspiro[5.5]undecane has a molecular weight of 181.32 g/mol, XLogP of 2.81, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-dimethyl-3-azaspiro[5.5]undecane is sourced from PubChem (CID 79320887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).