2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane

C16H29N3 — CID 166934305

IUPAC2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane
SMILESCC1CN(C2CCC3(CC2)CN(C2CN(C)C2)C3)C1
InChIInChI=1S/C16H29N3/c1-13-7-18(8-13)14-3-5-16(6-4-14)11-19(12-16)15-9-17(2)10-15/h13-15H,3-12H2,1-2H3
InChIKeySGBZFTKGDHRRNT-UHFFFAOYSA-N
MW263.43 g/mol
LogP1.50
Rot. Bonds2

About 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane

2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane (PubChem CID 166934305) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Name2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane
PubChem CID166934305
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC Name2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane
SMILESCC1CN(C2CCC3(CC2)CN(C2CN(C)C2)C3)C1
InChIInChI=1S/C16H29N3/c1-13-7-18(8-13)14-3-5-16(6-4-14)11-19(12-16)15-9-17(2)10-15/h13-15H,3-12H2,1-2H3
InChIKeySGBZFTKGDHRRNT-UHFFFAOYSA-N
XLogP1.50
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-methyl-2-[1-(1-methylazetidin-3-yl)piperidin-4-yl]-2-azaspiro[3.5]nonane
CID 170371772
5-(1-methylazetidin-3-yl)-5-azaspiro[2.3]hexane
CID 166489027
1-cyclodecyl-3-methylazetidine
CID 155016918
1-(1,4-dioxaspiro[4.5]decan-8-yl)-3-methylazetidine
CID 79672192
3,3-difluoro-1-(1-methylazetidin-3-yl)azetidine
CID 122608330
1-(9-methylspiro[5.5]undecan-3-yl)azetidine
CID 90712443
3,5-dimethyl-1-(1-methylpiperidin-4-yl)piperidine
CID 2846436
1-ethyl-4-(3-methylazetidin-1-yl)piperidine
CID 174247988
2-(1-tert-butylpiperidin-4-yl)-7-methyl-2,7-diazaspiro[3.5]nonane
CID 168769171
ethane;6-methyl-2-(1-methylpiperidin-4-yl)-2,6-diazaspiro[3.3]heptane
CID 171786053
3-(azetidin-1-yl)-1-methylazetidine;ethane
CID 170747536
8-methyl-2-(1-methylpiperidin-4-yl)-2,8-diazaspiro[4.5]decane
CID 155218569

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane?
The IUPAC name of 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane (CID 166934305) is 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane.
What is the SMILES notation for 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane?
The canonical SMILES for 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane is CC1CN(C2CCC3(CC2)CN(C2CN(C)C2)C3)C1.
What is the InChIKey of 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane?
The InChIKey is SGBZFTKGDHRRNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3/c1-13-7-18(8-13)14-3-5-16(6-4-14)11-19(12-16)15-9-17(2)10-15/h13-15H,3-12H2,1-2H3.
What are the key properties of 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane?
2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane has a molecular weight of 263.43 g/mol, XLogP of 1.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylazetidin-3-yl)-7-(3-methylazetidin-1-yl)-2-azaspiro[3.5]nonane is sourced from PubChem (CID 166934305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).