5,9,9-trimethyl-3-azaspiro[5.6]dodecane

C14H27N — CID 79321563

IUPAC5,9,9-trimethyl-3-azaspiro[5.6]dodecane
SMILESCC1CNCCC12CCCC(C)(C)CC2
InChIInChI=1S/C14H27N/c1-12-11-15-10-9-14(12)6-4-5-13(2,3)7-8-14/h12,15H,4-11H2,1-3H3
InChIKeyVHLHUVIVVQFRPG-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.59
Rot. Bonds

About 5,9,9-trimethyl-3-azaspiro[5.6]dodecane

5,9,9-trimethyl-3-azaspiro[5.6]dodecane (PubChem CID 79321563) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 5,9,9-trimethyl-3-azaspiro[5.6]dodecane.

Molecular Properties

Compound Name5,9,9-trimethyl-3-azaspiro[5.6]dodecane
PubChem CID79321563
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name5,9,9-trimethyl-3-azaspiro[5.6]dodecane
SMILESCC1CNCCC12CCCC(C)(C)CC2
InChIInChI=1S/C14H27N/c1-12-11-15-10-9-14(12)6-4-5-13(2,3)7-8-14/h12,15H,4-11H2,1-3H3
InChIKeyVHLHUVIVVQFRPG-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5,9-dimethyl-3-azaspiro[5.5]undecane
CID 79320887
5-(4-fluorophenyl)-9,9-dimethyl-3-azaspiro[5.6]dodecane
CID 79432872
5-methyl-9-propan-2-yl-3-azaspiro[5.5]undecane
CID 79321561
6-methyl-2,8-diazaspiro[4.5]decane
CID 83680090
11-methyl-2-thia-9-azaspiro[5.5]undecane
CID 79320397
4,4,10-trimethyl-8-azaspiro[4.5]decane
CID 79863004
(9R)-9-methylspiro[3.5]nonane
CID 140885739
(3R)-3,4-dimethylpiperidin-4-ol
CID 153404832
(4S)-4-methylspiro[4.4]nonane
CID 148967518
5,5,8,8-tetramethyl-azacycloundecane
CID 154959364
N,N,11-trimethyl-3,9-diazaspiro[5.5]undecane-3-carboxamide
CID 83265788
methanamine;7-methyl-5-azaspiro[2.4]heptane
CID 142211160

Frequently Asked Questions

What is the IUPAC name of 5,9,9-trimethyl-3-azaspiro[5.6]dodecane?
The IUPAC name of 5,9,9-trimethyl-3-azaspiro[5.6]dodecane (CID 79321563) is 5,9,9-trimethyl-3-azaspiro[5.6]dodecane.
What is the SMILES notation for 5,9,9-trimethyl-3-azaspiro[5.6]dodecane?
The canonical SMILES for 5,9,9-trimethyl-3-azaspiro[5.6]dodecane is CC1CNCCC12CCCC(C)(C)CC2.
What is the InChIKey of 5,9,9-trimethyl-3-azaspiro[5.6]dodecane?
The InChIKey is VHLHUVIVVQFRPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-12-11-15-10-9-14(12)6-4-5-13(2,3)7-8-14/h12,15H,4-11H2,1-3H3.
What are the key properties of 5,9,9-trimethyl-3-azaspiro[5.6]dodecane?
5,9,9-trimethyl-3-azaspiro[5.6]dodecane has a molecular weight of 209.38 g/mol, XLogP of 3.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9,9-trimethyl-3-azaspiro[5.6]dodecane is sourced from PubChem (CID 79321563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).