2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane

C13H24N2O — CID 166077728

IUPAC2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane
SMILESCOC1CC(N2CC3(CCN(C)CC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-14-5-3-13(4-6-14)9-15(10-13)11-7-12(8-11)16-2/h11-12H,3-10H2,1-2H3
InChIKeyYGRRHODIWYWICV-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.19
Rot. Bonds2

About 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane

2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane (PubChem CID 166077728) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane
PubChem CID166077728
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane
SMILESCOC1CC(N2CC3(CCN(C)CC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-14-5-3-13(4-6-14)9-15(10-13)11-7-12(8-11)16-2/h11-12H,3-10H2,1-2H3
InChIKeyYGRRHODIWYWICV-UHFFFAOYSA-N
XLogP1.19
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-Ethoxy-2,2-dimethylcyclobutyl)-4-methylpiperidine
CID 89935997
1-(3-Methoxycyclobutyl)-4-methylpiperidine
CID 126992009
7-(3-Methoxypropyl)-2-methyl-2,7-diazaspiro[3.5]nonane
CID 134351427
4-[(3-Methoxyazetidin-1-yl)methyl]-4-methyl-1-propan-2-ylpiperidine
CID 134505421
1-Butan-2-yl-4-[(3-methoxyazetidin-1-yl)methyl]-4-methylpiperidine
CID 142326930
3-methoxy-N-[(1-methylpiperidin-4-yl)methyl]-N-propan-2-ylcyclobutan-1-amine
CID 146183928
N-ethyl-3-methoxy-N-[(1-methylpiperidin-4-yl)methyl]cyclobutan-1-amine
CID 156183135
3-methoxy-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]cyclobutan-1-amine
CID 156183375
3-methoxy-N-methyl-N-[(1-propylpiperidin-4-yl)methyl]cyclobutan-1-amine
CID 156885185
4-Ethyl-1-(3-methoxycyclobutyl)piperidine
CID 164846335
(4S)-1-(3-methoxycyclobutyl)-3,3,4-trimethylpiperidine
CID 166077483
7-(3-Methoxycyclobutyl)-7-aza-2-azoniaspiro[3.5]nonane
CID 166077502

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane (CID 166077728) is 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane is COC1CC(N2CC3(CCN(C)CC3)C2)C1.
What is the InChIKey of 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane?
The InChIKey is YGRRHODIWYWICV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-14-5-3-13(4-6-14)9-15(10-13)11-7-12(8-11)16-2/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane?
2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane has a molecular weight of 224.35 g/mol, XLogP of 1.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxycyclobutyl)-7-methyl-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 166077728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).