9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione

C16H26N2O3 — CID 64960934

IUPAC9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(C)C1C(=O)NC2(CCCC2)C(=O)N1C1CCOCC1
InChIInChI=1S/C16H26N2O3/c1-11(2)13-14(19)17-16(7-3-4-8-16)15(20)18(13)12-5-9-21-10-6-12/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyUVHGWBJMYFTOEC-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.46
Rot. Bonds2

About 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione

9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64960934) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64960934
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC(C)C1C(=O)NC2(CCCC2)C(=O)N1C1CCOCC1
InChIInChI=1S/C16H26N2O3/c1-11(2)13-14(19)17-16(7-3-4-8-16)15(20)18(13)12-5-9-21-10-6-12/h11-13H,3-10H2,1-2H3,(H,17,19)
InChIKeyUVHGWBJMYFTOEC-UHFFFAOYSA-N
XLogP1.46
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64960934) is 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione is CC(C)C1C(=O)NC2(CCCC2)C(=O)N1C1CCOCC1.
What is the InChIKey of 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is UVHGWBJMYFTOEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-11(2)13-14(19)17-16(7-3-4-8-16)15(20)18(13)12-5-9-21-10-6-12/h11-13H,3-10H2,1-2H3,(H,17,19).
What are the key properties of 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 294.40 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(oxan-4-yl)-8-propan-2-yl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64960934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).