2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine

C14H28N2 — CID 58101761

IUPAC2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1CCC2(CCNCC2)CC1
InChIInChI=1S/C14H28N2/c1-16(2)12-5-13-3-6-14(7-4-13)8-10-15-11-9-14/h13,15H,3-12H2,1-2H3
InChIKeyNPWRWDVNIROJGW-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds3

About 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine

2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine (PubChem CID 58101761) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine
PubChem CID58101761
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1CCC2(CCNCC2)CC1
InChIInChI=1S/C14H28N2/c1-16(2)12-5-13-3-6-14(7-4-13)8-10-15-11-9-14/h13,15H,3-12H2,1-2H3
InChIKeyNPWRWDVNIROJGW-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-azaspiro[5.5]undecan-9-yl)ethanamine
CID 59505517
2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylacetamide;hydrochloride
CID 134069831
3-propyl-8-azaspiro[4.5]decane
CID 177021329
ethane;3-ethyl-8-azaspiro[4.5]decane
CID 170578114
2-azaspiro[4.5]decan-8-ylmethanamine
CID 71649170
N-ethyl-N-methyl-2-piperidin-4-ylethanamine
CID 43263497
2-(diazinan-4-yl)-N,N-dimethylethanamine
CID 23090108
9-bromo-3-azaspiro[5.5]undecane
CID 177171896
ethane;8-ethyl-2-azaspiro[4.6]undecane
CID 168995957
6-azaspiro[2.5]octane;ethane;propane
CID 176979994
[(5R,8R)-2-azaspiro[4.4]nonan-8-yl]methanol
CID 97169518
3-(3-azaspiro[5.5]undecan-9-yl)-3,9-diazaspiro[5.5]undecane
CID 146248908

Frequently Asked Questions

What is the IUPAC name of 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine (CID 58101761) is 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine is CN(C)CCC1CCC2(CCNCC2)CC1.
What is the InChIKey of 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine?
The InChIKey is NPWRWDVNIROJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-16(2)12-5-13-3-6-14(7-4-13)8-10-15-11-9-14/h13,15H,3-12H2,1-2H3.
What are the key properties of 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine?
2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-azaspiro[5.5]undecan-9-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 58101761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).