3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione

C17H22N2O2 — CID 64958744

IUPAC3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCC1C(=O)NC2(CCCCC2)C(=O)N1c1ccccc1
InChIInChI=1S/C17H22N2O2/c1-2-14-15(20)18-17(11-7-4-8-12-17)16(21)19(14)13-9-5-3-6-10-13/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H,18,20)
InChIKeyVMDWNMNEYULFPC-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.63
Rot. Bonds2

About 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione

3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione (PubChem CID 64958744) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione.

Molecular Properties

Compound Name3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
PubChem CID64958744
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
SMILESCCC1C(=O)NC2(CCCCC2)C(=O)N1c1ccccc1
InChIInChI=1S/C17H22N2O2/c1-2-14-15(20)18-17(11-7-4-8-12-17)16(21)19(14)13-9-5-3-6-10-13/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H,18,20)
InChIKeyVMDWNMNEYULFPC-UHFFFAOYSA-N
XLogP2.63
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887606
8-ethyl-9-(1-methylcyclopentyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64973613
4-butyl-3-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64886290
4-(4-bromophenyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64962592
8-ethyl-9-[2-(furan-2-yl)ethyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64964670
9-[(5-chlorothiophen-2-yl)methyl]-8-ethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64885696
4-methyl-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64885908
9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64962604
9-benzyl-8-tert-butyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887804
9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64961543
8-ethyl-9-(2-methylprop-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114619330
3-ethyl-4-(1,3-thiazol-2-ylmethyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64965781

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The IUPAC name of 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione (CID 64958744) is 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione.
What is the SMILES notation for 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The canonical SMILES for 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione is CCC1C(=O)NC2(CCCCC2)C(=O)N1c1ccccc1.
What is the InChIKey of 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
The InChIKey is VMDWNMNEYULFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-2-14-15(20)18-17(11-7-4-8-12-17)16(21)19(14)13-9-5-3-6-10-13/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H,18,20).
What are the key properties of 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione?
3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione has a molecular weight of 286.38 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione is sourced from PubChem (CID 64958744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).