2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine

C15H31N3 — CID 102850433

IUPAC2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine
SMILESCCN(CC)CCN1CCCC2(CCCNC2)C1
InChIInChI=1S/C15H31N3/c1-3-17(4-2)11-12-18-10-6-8-15(14-18)7-5-9-16-13-15/h16H,3-14H2,1-2H3
InChIKeyIJNSGVAFVWMNQK-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds5

About 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine

2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine (PubChem CID 102850433) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine
PubChem CID102850433
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine
SMILESCCN(CC)CCN1CCCC2(CCCNC2)C1
InChIInChI=1S/C15H31N3/c1-3-17(4-2)11-12-18-10-6-8-15(14-18)7-5-9-16-13-15/h16H,3-14H2,1-2H3
InChIKeyIJNSGVAFVWMNQK-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-ethoxypropyl)-2,8-diazaspiro[5.5]undecane
CID 102850195
6-(2,8-diazaspiro[5.5]undecan-2-yl)hexan-1-ol
CID 107705688
2-(2,9-diazaspiro[4.5]decan-2-yl)ethanamine
CID 130608102
2-(cyclobutylmethyl)-2,8-diazaspiro[5.5]undecane
CID 102849456
N-butan-2-yl-2-(2,8-diazaspiro[5.5]undecan-2-yl)acetamide
CID 102850222
2-(2,8-diazaspiro[5.5]undecan-2-yl)acetamide
CID 102850141
5-[2-(2,8-diazaspiro[5.5]undecan-2-yl)ethyl]-4-methyl-1,3-thiazole
CID 102850296
2-(3,3-dimethyl-1,5-diazocan-1-yl)-N,N-dimethylethanamine
CID 117014513
2-(2,8-diazaspiro[3.5]nonan-2-ylmethyl)-7-methyl-2,7-diazaspiro[3.5]nonane
CID 138702675
N'-[2-(1,4-diazepan-1-yl)ethyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102994465
N,N-diethyl-2-piperidin-1-ylethanamine;ethane
CID 176694882
4-[3-(2,8-diazaspiro[5.5]undecan-2-yl)propyl]phenol
CID 82038711

Frequently Asked Questions

What is the IUPAC name of 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine?
The IUPAC name of 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine (CID 102850433) is 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine.
What is the SMILES notation for 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine?
The canonical SMILES for 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine is CCN(CC)CCN1CCCC2(CCCNC2)C1.
What is the InChIKey of 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine?
The InChIKey is IJNSGVAFVWMNQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-3-17(4-2)11-12-18-10-6-8-15(14-18)7-5-9-16-13-15/h16H,3-14H2,1-2H3.
What are the key properties of 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine?
2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,8-diazaspiro[5.5]undecan-2-yl)-N,N-diethylethanamine is sourced from PubChem (CID 102850433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).