(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane

C9H18N2O — CID 129498775

IUPAC(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane
SMILESCCN1CCN[C@@]2(CCOC2)C1
InChIInChI=1S/C9H18N2O/c1-2-11-5-4-10-9(7-11)3-6-12-8-9/h10H,2-8H2,1H3/t9-/m0/s1
InChIKeyGURBJRKCTMCBNZ-VIFPVBQESA-N
MW170.26 g/mol
LogP0.07
Rot. Bonds1

About (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane

(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane (PubChem CID 129498775) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane
PubChem CID129498775
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane
SMILESCCN1CCN[C@@]2(CCOC2)C1
InChIInChI=1S/C9H18N2O/c1-2-11-5-4-10-9(7-11)3-6-12-8-9/h10H,2-8H2,1H3/t9-/m0/s1
InChIKeyGURBJRKCTMCBNZ-VIFPVBQESA-N
XLogP0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;7-ethyl-4,7-diazaspiro[2.5]octane
CID 176567452
4-ethyl-1,4,9-triazaspiro[5.5]undecane
CID 167290889
ethane;7-ethyl-1,7-diazaspiro[3.4]octane;molecular hydrogen
CID 143973878
(5R)-7-ethyl-2-oxa-7-azaspiro[4.4]nonane
CID 142524383
8-ethyl-1,8-diazaspiro[5.5]undecane
CID 83618601
9-ethyl-2-oxa-9-azaspiro[4.5]decane
CID 146386643
2,10-dioxa-6-azaspiro[4.6]undecane
CID 118209581
2-tert-butyl-9-oxa-2,6-diazaspiro[4.5]decane
CID 162462266
8-ethyl-2-oxa-8-azaspiro[5.5]undecane
CID 153357345
7-ethyl-1-oxa-7-azaspiro[3.4]octane
CID 121247158
10-methyl-3-oxa-7,10-diazaspiro[5.6]dodecane;dihydrochloride
CID 138015579
bis(7-oxa-1-azaspiro[3.4]octane);oxalic acid
CID 91663917

Frequently Asked Questions

What is the IUPAC name of (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane?
The IUPAC name of (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane (CID 129498775) is (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane.
What is the SMILES notation for (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane?
The canonical SMILES for (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane is CCN1CCN[C@@]2(CCOC2)C1.
What is the InChIKey of (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane?
The InChIKey is GURBJRKCTMCBNZ-VIFPVBQESA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-11-5-4-10-9(7-11)3-6-12-8-9/h10H,2-8H2,1H3/t9-/m0/s1.
What are the key properties of (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane?
(5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane has a molecular weight of 170.26 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-9-ethyl-2-oxa-6,9-diazaspiro[4.5]decane is sourced from PubChem (CID 129498775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).