2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane

C13H26N2 — CID 82470794

IUPAC2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane
SMILESCC(C)CCN1CCC2(CCNCC2)C1
InChIInChI=1S/C13H26N2/c1-12(2)3-9-15-10-6-13(11-15)4-7-14-8-5-13/h12,14H,3-11H2,1-2H3
InChIKeyVVZLSZOTCGEOKF-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.11
Rot. Bonds3

About 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane

2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane (PubChem CID 82470794) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane
PubChem CID82470794
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane
SMILESCC(C)CCN1CCC2(CCNCC2)C1
InChIInChI=1S/C13H26N2/c1-12(2)3-9-15-10-6-13(11-15)4-7-14-8-5-13/h12,14H,3-11H2,1-2H3
InChIKeyVVZLSZOTCGEOKF-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,3,3-trifluoropropyl)-2,8-diazaspiro[4.5]decane;dihydrochloride
CID 154885864
2-[(1-methylcyclobutyl)methyl]-2,8-diazaspiro[4.5]decane
CID 120906458
(1R,5R)-1,5-dimethyl-3-(3-methylbutyl)-3,7-diazabicyclo[3.3.1]nonane
CID 98114729
2,8-bis(2-methylpropyl)-2,8-diazaspiro[4.5]decane
CID 129193421
4,4-difluoro-1-(3-methylbutyl)piperidine
CID 20811830
2-[(4-propan-2-ylphenyl)methyl]-2,8-diazaspiro[4.5]decane;dihydrochloride
CID 154891864
2-(2-methylsulfanylethyl)-2,7-diazaspiro[4.4]nonane
CID 130525850
2-(2,7-diazaspiro[4.4]nonan-2-yl)ethanamine
CID 128922534
2-[(4-methyloxan-4-yl)methyl]-2,8-diazaspiro[4.5]decane;dihydrochloride
CID 154905756
3,3-difluoro-1-(3-methylbutyl)piperidine
CID 59748001
[3-amino-1-(3-methylbutyl)pyrrolidin-3-yl]methanol
CID 117012217
3,3-diethyl-1-(3-methylbutyl)piperazine
CID 64833456

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane (CID 82470794) is 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane is CC(C)CCN1CCC2(CCNCC2)C1.
What is the InChIKey of 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane?
The InChIKey is VVZLSZOTCGEOKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-12(2)3-9-15-10-6-13(11-15)4-7-14-8-5-13/h12,14H,3-11H2,1-2H3.
What are the key properties of 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane?
2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane has a molecular weight of 210.36 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutyl)-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 82470794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).