9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione

C15H23ClN2O2 — CID 107902258

IUPAC9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1(CC)C(=O)NC2(CCCC2)C(=O)N1C/C=C/Cl
InChIInChI=1S/C15H23ClN2O2/c1-3-15(4-2)12(19)17-14(8-5-6-9-14)13(20)18(15)11-7-10-16/h7,10H,3-6,8-9,11H2,1-2H3,(H,17,19)/b10-7+
InChIKeyIQSCKADFUCMVHE-JXMROGBWSA-N
MW298.81 g/mol
LogP2.57
Rot. Bonds4

About 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione

9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 107902258) has the molecular formula C15H23ClN2O2 and a molecular weight of 298.81 g/mol. Its IUPAC name is 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID107902258
Molecular FormulaC15H23ClN2O2
Molecular Weight298.81 g/mol
Exact Mass298.14
IUPAC Name9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1(CC)C(=O)NC2(CCCC2)C(=O)N1C/C=C/Cl
InChIInChI=1S/C15H23ClN2O2/c1-3-15(4-2)12(19)17-14(8-5-6-9-14)13(20)18(15)11-7-10-16/h7,10H,3-6,8-9,11H2,1-2H3,(H,17,19)/b10-7+
InChIKeyIQSCKADFUCMVHE-JXMROGBWSA-N
XLogP2.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.81
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione with MolForge

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Related Compounds

1-[(E)-3-chloroprop-2-enyl]-6,6-diethyl-3-methylpiperazine-2,5-dione
CID 107902012
14-[(E)-but-2-enyl]-6,14-diazadispiro[4.2.58.25]pentadecane-7,15-dione
CID 107898324
9-ethyl-8,8-dimethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886492
8,8-dimethyl-9-(3-methylbut-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107902275
8-ethyl-8-methyl-9-(3,3,3-trifluoropropyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64884941
1-[(E)-3-chloroprop-2-enyl]-3-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107902131
8-ethyl-8-methyl-9-(3-methylbutyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886661
3-ethyl-3-methyl-4-(3-methylbutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64885925
3-ethyl-4-(2-methoxyethyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64886116
8-ethyl-8-methyl-9-(2-propoxyethyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 106459063
4-(cyclobutylmethyl)-3,3-dimethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 65462286
14-(2-methylpropyl)-7,14-diazadispiro[4.2.48.25]tetradecane-6,13-dione
CID 64886855

Frequently Asked Questions

What is the IUPAC name of 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 107902258) is 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione is CCC1(CC)C(=O)NC2(CCCC2)C(=O)N1C/C=C/Cl.
What is the InChIKey of 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is IQSCKADFUCMVHE-JXMROGBWSA-N. The full InChI is InChI=1S/C15H23ClN2O2/c1-3-15(4-2)12(19)17-14(8-5-6-9-14)13(20)18(15)11-7-10-16/h7,10H,3-6,8-9,11H2,1-2H3,(H,17,19)/b10-7+.
What are the key properties of 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione?
9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 298.81 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(E)-3-chloroprop-2-enyl]-8,8-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 107902258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).