6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione

C16H28N2O3 — CID 64873585

IUPAC6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCCC1NC(=O)C2(CCCC2)N(CCOC(C)C)C1=O
InChIInChI=1S/C16H28N2O3/c1-4-7-13-14(19)18(10-11-21-12(2)3)16(15(20)17-13)8-5-6-9-16/h12-13H,4-11H2,1-3H3,(H,17,20)
InChIKeySAMXGPCLZHXAID-UHFFFAOYSA-N
MW296.41 g/mol
LogP1.85
Rot. Bonds6

About 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione

6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64873585) has the molecular formula C16H28N2O3 and a molecular weight of 296.41 g/mol. Its IUPAC name is 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64873585
Molecular FormulaC16H28N2O3
Molecular Weight296.41 g/mol
Exact Mass296.21
IUPAC Name6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCCC1NC(=O)C2(CCCC2)N(CCOC(C)C)C1=O
InChIInChI=1S/C16H28N2O3/c1-4-7-13-14(19)18(10-11-21-12(2)3)16(15(20)17-13)8-5-6-9-16/h12-13H,4-11H2,1-3H3,(H,17,20)
InChIKeySAMXGPCLZHXAID-UHFFFAOYSA-N
XLogP1.85
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64873585) is 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione is CCCC1NC(=O)C2(CCCC2)N(CCOC(C)C)C1=O.
What is the InChIKey of 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is SAMXGPCLZHXAID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O3/c1-4-7-13-14(19)18(10-11-21-12(2)3)16(15(20)17-13)8-5-6-9-16/h12-13H,4-11H2,1-3H3,(H,17,20).
What are the key properties of 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione?
6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 296.41 g/mol, XLogP of 1.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-propan-2-yloxyethyl)-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64873585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).