2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane

C13H24N2 — CID 79677168

IUPAC2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane
SMILESC1CCC2(CC1)CN(CC1CCCN1)C2
InChIInChI=1S/C13H24N2/c1-2-6-13(7-3-1)10-15(11-13)9-12-5-4-8-14-12/h12,14H,1-11H2
InChIKeyUHFKPNHDJJSKRA-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.00
Rot. Bonds2

About 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane

2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane (PubChem CID 79677168) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Name2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane
PubChem CID79677168
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane
SMILESC1CCC2(CC1)CN(CC1CCCN1)C2
InChIInChI=1S/C13H24N2/c1-2-6-13(7-3-1)10-15(11-13)9-12-5-4-8-14-12/h12,14H,1-11H2
InChIKeyUHFKPNHDJJSKRA-UHFFFAOYSA-N
XLogP2.00
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,6,6-tetramethyl-4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine
CID 102819699
2-[(3,3-dimethylpiperidin-2-yl)methyl]-2-azaspiro[3.5]nonane
CID 114083981
3,3-difluoro-1-(pyrrolidin-2-ylmethyl)piperidine
CID 115023488
8-(pyrrolidin-2-ylmethyl)-8-azaspiro[4.5]decane-7,9-dione
CID 62540613
1-(pyrrolidin-2-ylmethyl)piperazine
CID 53406264
2-(3-piperidin-2-ylpropyl)-2-azaspiro[4.4]nonane
CID 114279332
7,7-dimethyl-4-(pyrrolidin-2-ylmethyl)-1,4-thiazepane
CID 107455301
[3-fluoro-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrrolidin-3-yl]methanol
CID 130719897
(3aS,6aR)-2-[[(2S)-pyrrolidin-2-yl]methyl]-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 142354137
ethane;propane;1-(pyrrolidin-2-ylmethyl)pyrrolidine
CID 143192100
1-cyclohexyl-4-[[(2S)-pyrrolidin-2-yl]methyl]piperazine
CID 126542421
2,2-dimethyl-4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine
CID 93204728

Frequently Asked Questions

What is the IUPAC name of 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane?
The IUPAC name of 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane (CID 79677168) is 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane.
What is the SMILES notation for 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane?
The canonical SMILES for 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane is C1CCC2(CC1)CN(CC1CCCN1)C2.
What is the InChIKey of 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane?
The InChIKey is UHFKPNHDJJSKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-2-6-13(7-3-1)10-15(11-13)9-12-5-4-8-14-12/h12,14H,1-11H2.
What are the key properties of 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane?
2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane has a molecular weight of 208.35 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrrolidin-2-ylmethyl)-2-azaspiro[3.5]nonane is sourced from PubChem (CID 79677168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).