14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione

C17H26N2O2 — CID 107898324

IUPAC14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione
SMILESC/C=C/CN1C(=O)C2(CCCC2)NC(=O)C12CCCCC2
InChIInChI=1S/C17H26N2O2/c1-2-3-13-19-15(21)16(9-7-8-10-16)18-14(20)17(19)11-5-4-6-12-17/h2-3H,4-13H2,1H3,(H,18,20)/b3-2+
InChIKeyVUOUODGJYJBOJI-NSCUHMNNSA-N
MW290.41 g/mol
LogP2.54
Rot. Bonds2

About 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione

14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione (PubChem CID 107898324) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione.

Molecular Properties

Compound Name14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione
PubChem CID107898324
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione
SMILESC/C=C/CN1C(=O)C2(CCCC2)NC(=O)C12CCCCC2
InChIInChI=1S/C17H26N2O2/c1-2-3-13-19-15(21)16(9-7-8-10-16)18-14(20)17(19)11-5-4-6-12-17/h2-3H,4-13H2,1H3,(H,18,20)/b3-2+
InChIKeyVUOUODGJYJBOJI-NSCUHMNNSA-N
XLogP2.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

15-(2-methylpropyl)-7,15-diazadispiro[4.2.58.25]pentadecane-6,14-dione
CID 64884969
14-(2-methylpropyl)-7,14-diazadispiro[4.2.48.25]tetradecane-6,13-dione
CID 64886855
1-[(E)-but-2-enyl]-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107898199
3,3-dimethyl-1-prop-2-enyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64902390
1-[(E)-but-2-enyl]-3-propyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107898217
6-[(E)-but-2-enyl]-8-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107898216
9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107902258
8,8-dimethyl-9-(3-methylbut-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107902275
8-butan-2-yl-6-[(E)-but-2-enyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107898298
9-ethyl-8,8-dimethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886492
8-ethyl-8-methyl-6-(3-methylbut-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107902236
4-(cyclobutylmethyl)-3,3-dimethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 65462286

Frequently Asked Questions

What is the IUPAC name of 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione?
The IUPAC name of 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione (CID 107898324) is 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione.
What is the SMILES notation for 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione?
The canonical SMILES for 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione is C/C=C/CN1C(=O)C2(CCCC2)NC(=O)C12CCCCC2.
What is the InChIKey of 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione?
The InChIKey is VUOUODGJYJBOJI-NSCUHMNNSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-2-3-13-19-15(21)16(9-7-8-10-16)18-14(20)17(19)11-5-4-6-12-17/h2-3H,4-13H2,1H3,(H,18,20)/b3-2+.
What are the key properties of 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione?
14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione has a molecular weight of 290.41 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione is sourced from PubChem (CID 107898324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).