4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane

C17H32N2O — CID 82736919

IUPAC4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
SMILESCC(C)C1CNC2(CCCCC2)CN1C1CCOC1C
InChIInChI=1S/C17H32N2O/c1-13(2)16-11-18-17(8-5-4-6-9-17)12-19(16)15-7-10-20-14(15)3/h13-16,18H,4-12H2,1-3H3
InChIKeyYJRJAUWLNBSZJQ-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.80
Rot. Bonds2

About 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane

4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane (PubChem CID 82736919) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
PubChem CID82736919
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
SMILESCC(C)C1CNC2(CCCCC2)CN1C1CCOC1C
InChIInChI=1S/C17H32N2O/c1-13(2)16-11-18-17(8-5-4-6-9-17)12-19(16)15-7-10-20-14(15)3/h13-16,18H,4-12H2,1-3H3
InChIKeyYJRJAUWLNBSZJQ-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cycloheptyl-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64934612
8-propan-2-yl-9-(2,2,3,3-tetramethylcyclopropyl)-6,9-diazaspiro[4.5]decane
CID 79350195
9-(2,2-dimethylcyclopentyl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 79879064
4-(oxan-2-ylmethyl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64875697
4-[2-(oxolan-2-yl)ethyl]-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64947296
1-(2-methyloxolan-3-yl)-2-propan-2-yl-5-propylpiperazine
CID 82737019
9-[3-(oxolan-2-yl)propyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 65170041
4-(5-methylhexan-2-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64939492
3-methyl-4-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64877798
2-methyl-1-(2-methyloxolan-3-yl)-5-propan-2-ylpiperazine
CID 82736442
9-[(1-methylpiperidin-3-yl)methyl]-8-propan-2-yl-6,9-diazaspiro[4.5]decane
CID 64947685
2-(2-methyloxolan-3-yl)-3-propan-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 82737587

Frequently Asked Questions

What is the IUPAC name of 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane (CID 82736919) is 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane is CC(C)C1CNC2(CCCCC2)CN1C1CCOC1C.
What is the InChIKey of 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane?
The InChIKey is YJRJAUWLNBSZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-13(2)16-11-18-17(8-5-4-6-9-17)12-19(16)15-7-10-20-14(15)3/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane?
4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane has a molecular weight of 280.46 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methyloxolan-3-yl)-3-propan-2-yl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 82736919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).