2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane

C17H26N2 — CID 79320158

IUPAC2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane
SMILESCCC1CNCCC12CCN(Cc1ccccc1)C2
InChIInChI=1S/C17H26N2/c1-2-16-12-18-10-8-17(16)9-11-19(14-17)13-15-6-4-3-5-7-15/h3-7,16,18H,2,8-14H2,1H3
InChIKeyKMYIJJVWMSHIFS-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.90
Rot. Bonds3

About 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane

2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane (PubChem CID 79320158) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane
PubChem CID79320158
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC Name2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane
SMILESCCC1CNCCC12CCN(Cc1ccccc1)C2
InChIInChI=1S/C17H26N2/c1-2-16-12-18-10-8-17(16)9-11-19(14-17)13-15-6-4-3-5-7-15/h3-7,16,18H,2,8-14H2,1H3
InChIKeyKMYIJJVWMSHIFS-UHFFFAOYSA-N
XLogP2.90
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-benzyl-11-ethyl-2,9-diazaspiro[5.5]undecane
CID 79321420
2-benzyl-6-propyl-2,8-diazaspiro[4.5]decane
CID 79321591
2-benzyl-6-(4-methylphenyl)-2,8-diazaspiro[4.5]decane
CID 113247774
2-benzyl-11-propan-2-yl-2,9-diazaspiro[5.5]undecane
CID 79310836
3-benzyl-11-(2-methoxyphenyl)-3,9-diazaspiro[5.5]undecane
CID 153204590
[(4S)-2-benzyl-2,8-diazaspiro[4.5]decan-4-yl]methanol
CID 99728174
2-benzyl-1-ethyl-2,8-diazaspiro[4.5]decane
CID 83851488
2-benzyl-2,10-diazaspiro[4.6]undecan-6-ol
CID 83488694
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
CID 142253116
6-benzyl-1,2,3,4,5,7,8,8a-octahydro-2,6-naphthyridin-4a-ol
CID 83669932
4-benzyl-3,4-diethylpiperidine
CID 79312303

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane (CID 79320158) is 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane is CCC1CNCCC12CCN(Cc1ccccc1)C2.
What is the InChIKey of 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane?
The InChIKey is KMYIJJVWMSHIFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-2-16-12-18-10-8-17(16)9-11-19(14-17)13-15-6-4-3-5-7-15/h3-7,16,18H,2,8-14H2,1H3.
What are the key properties of 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane?
2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane has a molecular weight of 258.41 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-6-ethyl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 79320158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).