6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane

C16H32N2 — CID 79446556

IUPAC6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane
SMILESCCC(C)N1CC(CC)(CC)NCC12CCCC2
InChIInChI=1S/C16H32N2/c1-5-14(4)18-13-15(6-2,7-3)17-12-16(18)10-8-9-11-16/h14,17H,5-13H2,1-4H3
InChIKeySNEOYCCROPJTDO-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.56
Rot. Bonds4

About 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane

6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane (PubChem CID 79446556) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane
PubChem CID79446556
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane
SMILESCCC(C)N1CC(CC)(CC)NCC12CCCC2
InChIInChI=1S/C16H32N2/c1-5-14(4)18-13-15(6-2,7-3)17-12-16(18)10-8-9-11-16/h14,17H,5-13H2,1-4H3
InChIKeySNEOYCCROPJTDO-UHFFFAOYSA-N
XLogP3.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8,8-diethyl-6-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64861426
3,3-diethyl-1-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64861044
1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane
CID 82937126
6-butan-2-yl-8-propyl-6,9-diazaspiro[4.5]decane
CID 79444829
6-butan-2-yl-8-(2-methylpropyl)-6,9-diazaspiro[4.5]decane
CID 79445456
6-(2-butoxyethyl)-8,8-diethyl-6,9-diazaspiro[4.5]decane
CID 64861043
8,8-diethyl-6-(pyridin-3-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64860083
14-(2-methylbutyl)-7,14-diazadispiro[4.2.48.25]tetradecane
CID 64878172
6-(2-ethylbutyl)-8,8-dimethyl-6,9-diazaspiro[4.5]decane
CID 82923848
8-ethyl-6,8-dimethyl-6,9-diazaspiro[4.5]decane
CID 64875613
2,5,5-triethyl-2-methyl-1-(2-methylbutyl)piperazine
CID 64861806
5,5-diethyl-1-(2-ethylbutyl)-2,2-dimethylpiperazine
CID 82925143

Frequently Asked Questions

What is the IUPAC name of 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The IUPAC name of 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane (CID 79446556) is 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The canonical SMILES for 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane is CCC(C)N1CC(CC)(CC)NCC12CCCC2.
What is the InChIKey of 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane?
The InChIKey is SNEOYCCROPJTDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-14(4)18-13-15(6-2,7-3)17-12-16(18)10-8-9-11-16/h14,17H,5-13H2,1-4H3.
What are the key properties of 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane?
6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane has a molecular weight of 252.45 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butan-2-yl-8,8-diethyl-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 79446556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).