9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C15H17BrN2O2 — CID 64961543

IUPAC9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1c1cccc(Br)c1
InChIInChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(7-2-3-8-15)14(20)18(10)12-6-4-5-11(16)9-12/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,19)
InChIKeyVYOMMRLPPXSKLM-UHFFFAOYSA-N
MW337.22 g/mol
LogP2.61
Rot. Bonds1

About 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64961543) has the molecular formula C15H17BrN2O2 and a molecular weight of 337.22 g/mol. Its IUPAC name is 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64961543
Molecular FormulaC15H17BrN2O2
Molecular Weight337.22 g/mol
Exact Mass336.05
IUPAC Name9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1c1cccc(Br)c1
InChIInChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(7-2-3-8-15)14(20)18(10)12-6-4-5-11(16)9-12/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,19)
InChIKeyVYOMMRLPPXSKLM-UHFFFAOYSA-N
XLogP2.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.22
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64962604
4-(4-bromophenyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64962592
9-(3-chloro-5-fluorophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107370938
3-methyl-4-pyrimidin-5-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107590294
8-methyl-9-(2-methyl-3-pyridinyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 79043870
3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64958744
3-[(3-bromophenyl)methyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 47094861
9-[(4-bromothiophen-2-yl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64885149
(2S)-2-(3-bromophenyl)-1,4-diazaspiro[4.4]nonan-3-one
CID 86334224
1-(3-bromophenyl)-3,3-dimethyl-3a,4,5,6,7,7a-hexahydropyrrolo[3,2-b]pyridin-2-one
CID 84605575
2-(3-bromophenyl)-2-azaspiro[4.5]decane-1,3-dione
CID 43385974
1-(3-bromo-4-methylphenyl)-3-cyclopropyl-3,6-dimethylpiperazine-2,5-dione
CID 64970664

Frequently Asked Questions

What is the IUPAC name of 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64961543) is 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is CC1C(=O)NC2(CCCC2)C(=O)N1c1cccc(Br)c1.
What is the InChIKey of 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is VYOMMRLPPXSKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(7-2-3-8-15)14(20)18(10)12-6-4-5-11(16)9-12/h4-6,9-10H,2-3,7-8H2,1H3,(H,17,19).
What are the key properties of 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 337.22 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64961543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).