magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide

C57H97Br3MgN4O6Si3 — CID 160811480

IUPACmagnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide
SMILESC.C.C1CC2CCC1O2.C[Si](C)(C)Br.C[Si](C)(C)OC1CCC(Br)CC1.C[Si](C)(C)OC1CC[CH-]CC1.O=Cc1c(C2CC2)ccc2cncn12.OC1CCC(C(O)c2c(C3CC3)ccc3cncn23)CC1.[Br-].[Mg+2]
InChIInChI=1S/C17H22N2O2.C11H10N2O.C9H19BrOSi.C9H19OSi.C6H10O.C3H9BrSi.2CH4.BrH.Mg/c20-14-6-3-12(4-7-14)17(21)16-15(11-1-2-11)8-5-13-9-18-10-19(13)16;14-6-11-10(8-1-2-8)4-3-9-5-12-7-13(9)11;1-12(2,3)11-9-6-4-8(10)5-7-9;1-11(2,3)10-9-7-5-4-6-8-9;1-2-6-4-3-5(1)7-6;1-5(2,3)4;;;;/h5,8-12,14,17,20-21H,1-4,6-7H2;3-8H,1-2H2;8-9H,4-7H2,1-3H3;4,9H,5-8H2,1-3H3;5-6H,1-4H2;1-3H3;2*1H4;1H;/q;;;-1;;;;;;+2/p-1
InChIKeyVYNDVLKOXMVVGM-UHFFFAOYSA-M
MW1282.70 g/mol
LogP12.79
Rot. Bonds9

About magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide

magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide (PubChem CID 160811480) has the molecular formula C57H97Br3MgN4O6Si3 and a molecular weight of 1282.70 g/mol. Its IUPAC name is magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide.

Molecular Properties

Compound Namemagnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide
PubChem CID160811480
Molecular FormulaC57H97Br3MgN4O6Si3
Molecular Weight1282.70 g/mol
Exact Mass1278.41
IUPAC Namemagnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide
SMILESC.C.C1CC2CCC1O2.C[Si](C)(C)Br.C[Si](C)(C)OC1CCC(Br)CC1.C[Si](C)(C)OC1CC[CH-]CC1.O=Cc1c(C2CC2)ccc2cncn12.OC1CCC(C(O)c2c(C3CC3)ccc3cncn23)CC1.[Br-].[Mg+2]
InChIInChI=1S/C17H22N2O2.C11H10N2O.C9H19BrOSi.C9H19OSi.C6H10O.C3H9BrSi.2CH4.BrH.Mg/c20-14-6-3-12(4-7-14)17(21)16-15(11-1-2-11)8-5-13-9-18-10-19(13)16;14-6-11-10(8-1-2-8)4-3-9-5-12-7-13(9)11;1-12(2,3)11-9-6-4-8(10)5-7-9;1-11(2,3)10-9-7-5-4-6-8-9;1-2-6-4-3-5(1)7-6;1-5(2,3)4;;;;/h5,8-12,14,17,20-21H,1-4,6-7H2;3-8H,1-2H2;8-9H,4-7H2,1-3H3;4,9H,5-8H2,1-3H3;5-6H,1-4H2;1-3H3;2*1H4;1H;/q;;;-1;;;;;;+2/p-1
InChIKeyVYNDVLKOXMVVGM-UHFFFAOYSA-M
XLogP12.79
TPSA119.82 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds9
Heavy Atoms74
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001282.70
LogP ≤ 512.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

Analyze magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide with MolForge

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Related Compounds

CID 157723753
CID 157723753
4-[4-[(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzoic acid;4-[4-[(S)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]benzoic acid
CID 157886341
CID 158186354
CID 158186354
6-Bromoimidazo[1,5-a]pyridine-5-carbaldehyde;cyclohexyl-(6-ethynylimidazo[1,5-a]pyridin-5-yl)methanol;cyclohexyl-[6-(2-trimethylsilylethynyl)imidazo[1,5-a]pyridin-5-yl]methanol;methane;6-(2-trimethylsilylethynyl)imidazo[1,5-a]pyridine-5-carbaldehyde
CID 158785662
4-[4-[(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]-N,N-dimethylbenzamide;4-[4-[(S)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexyl]-N,N-dimethylbenzamide
CID 159413483
CID 159557721
CID 159557721
CID 160669982
CID 160669982
(6-Bromoimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanol;(6-bromoimidazo[1,5-a]pyridin-5-yl)-cyclohexylmethanone;cyclohexyl-(6-methylimidazo[1,5-a]pyridin-5-yl)methanol;cyclohexyl-(6-methylimidazo[1,5-a]pyridin-5-yl)methanone;methane
CID 160750506
6-Bromoimidazo[1,5-a]pyridine-5-carbaldehyde;cyclohexyl-(6-ethynylimidazo[1,5-a]pyridin-5-yl)methanol;cyclohexyl-[6-(2-trimethylsilylethynyl)imidazo[1,5-a]pyridin-5-yl]methanol;methane;6-(2-trimethylsilylethynyl)imidazo[1,5-a]pyridine-5-carbaldehyde
CID 161534396
Magnesium;cyclohexane;cyclohexyl(imidazo[1,5-a]pyridin-5-yl)methanol;imidazo[1,5-a]pyridine-5-carbaldehyde;imidazo[1,5-a]pyridin-5-ylmethanol;methane;chloride
CID 162037272

Frequently Asked Questions

What is the IUPAC name of magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide?
The IUPAC name of magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide (CID 160811480) is magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide.
What is the SMILES notation for magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide?
The canonical SMILES for magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide is C.C.C1CC2CCC1O2.C[Si](C)(C)Br.C[Si](C)(C)OC1CCC(Br)CC1.C[Si](C)(C)OC1CC[CH-]CC1.O=Cc1c(C2CC2)ccc2cncn12.OC1CCC(C(O)c2c(C3CC3)ccc3cncn23)CC1.[Br-].[Mg+2].
What is the InChIKey of magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide?
The InChIKey is VYNDVLKOXMVVGM-UHFFFAOYSA-M. The full InChI is InChI=1S/C17H22N2O2.C11H10N2O.C9H19BrOSi.C9H19OSi.C6H10O.C3H9BrSi.2CH4.BrH.Mg/c20-14-6-3-12(4-7-14)17(21)16-15(11-1-2-11)8-5-13-9-18-10-19(13)16;14-6-11-10(8-1-2-8)4-3-9-5-12-7-13(9)11;1-12(2,3)11-9-6-4-8(10)5-7-9;1-11(2,3)10-9-7-5-4-6-8-9;1-2-6-4-3-5(1)7-6;1-5(2,3)4;;;;/h5,8-12,14,17,20-21H,1-4,6-7H2;3-8H,1-2H2;8-9H,4-7H2,1-3H3;4,9H,5-8H2,1-3H3;5-6H,1-4H2;1-3H3;2*1H4;1H;/q;;;-1;;;;;;+2/p-1.
What are the key properties of magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide?
magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide has a molecular weight of 1282.70 g/mol, XLogP of 12.79, 9 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;(4-bromocyclohexyl)oxy-trimethylsilane;bromo(trimethyl)silane;cyclohexyloxy(trimethyl)silane;6-cyclopropylimidazo[1,5-a]pyridine-5-carbaldehyde;4-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol;methane;7-oxabicyclo[2.2.1]heptane;bromide is sourced from PubChem (CID 160811480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).