9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

C15H17BrN2O2 — CID 64962604

IUPAC9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1c1ccc(Br)cc1
InChIInChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(8-2-3-9-15)14(20)18(10)12-6-4-11(16)5-7-12/h4-7,10H,2-3,8-9H2,1H3,(H,17,19)
InChIKeyNAHSPTDOAMKSLN-UHFFFAOYSA-N
MW337.22 g/mol
LogP2.61
Rot. Bonds1

About 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 64962604) has the molecular formula C15H17BrN2O2 and a molecular weight of 337.22 g/mol. Its IUPAC name is 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID64962604
Molecular FormulaC15H17BrN2O2
Molecular Weight337.22 g/mol
Exact Mass336.05
IUPAC Name9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCC1C(=O)NC2(CCCC2)C(=O)N1c1ccc(Br)cc1
InChIInChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(8-2-3-9-15)14(20)18(10)12-6-4-11(16)5-7-12/h4-7,10H,2-3,8-9H2,1H3,(H,17,19)
InChIKeyNAHSPTDOAMKSLN-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

4-(4-bromophenyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64962592
9-(3-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64961543
3-methyl-4-pyrimidin-5-yl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 107590294
9-(3-chloro-5-fluorophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 107370938
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
9-[(4-bromothiophen-2-yl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64885149
3-methyl-4-(1-methylcyclohexyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64968199
8-methyl-9-[(4-methylphenyl)methyl]-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886488
4-(cyclopropylmethyl)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64887432
3-methyl-4-(2,3,3-trimethylbutyl)-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 83145037
8-methyl-9-propyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64886681

Frequently Asked Questions

What is the IUPAC name of 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione (CID 64962604) is 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is CC1C(=O)NC2(CCCC2)C(=O)N1c1ccc(Br)cc1.
What is the InChIKey of 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is NAHSPTDOAMKSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O2/c1-10-13(19)17-15(8-2-3-9-15)14(20)18(10)12-6-4-11(16)5-7-12/h4-7,10H,2-3,8-9H2,1H3,(H,17,19).
What are the key properties of 9-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione?
9-(4-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-(4-bromophenyl)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 64962604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).