7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane

C15H29NO3 — CID 68840597

IUPAC7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCCC1(C)CC2(OCC(C)O2)C(C)C(C)(CC)N1O
InChIInChI=1S/C15H29NO3/c1-7-13(5)10-15(18-9-11(3)19-15)12(4)14(6,8-2)16(13)17/h11-12,17H,7-10H2,1-6H3
InChIKeyFKZPQPLKWPREHR-UHFFFAOYSA-N
MW271.40 g/mol
LogP3.19
Rot. Bonds2

About 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane

7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane (PubChem CID 68840597) has the molecular formula C15H29NO3 and a molecular weight of 271.40 g/mol. Its IUPAC name is 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane
PubChem CID68840597
Molecular FormulaC15H29NO3
Molecular Weight271.40 g/mol
Exact Mass271.21
IUPAC Name7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane
SMILESCCC1(C)CC2(OCC(C)O2)C(C)C(C)(CC)N1O
InChIInChI=1S/C15H29NO3/c1-7-13(5)10-15(18-9-11(3)19-15)12(4)14(6,8-2)16(13)17/h11-12,17H,7-10H2,1-6H3
InChIKeyFKZPQPLKWPREHR-UHFFFAOYSA-N
XLogP3.19
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane?
The IUPAC name of 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane (CID 68840597) is 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane?
The canonical SMILES for 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane is CCC1(C)CC2(OCC(C)O2)C(C)C(C)(CC)N1O.
What is the InChIKey of 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane?
The InChIKey is FKZPQPLKWPREHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO3/c1-7-13(5)10-15(18-9-11(3)19-15)12(4)14(6,8-2)16(13)17/h11-12,17H,7-10H2,1-6H3.
What are the key properties of 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane?
7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane has a molecular weight of 271.40 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-diethyl-8-hydroxy-3,6,7,9-tetramethyl-1,4-dioxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 68840597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).