carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)

C20H48Cl2N2Si2Zr — CID 162293186

IUPACcarbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)
SMILESCN(C)[Si](C)(C)C1CCCC1.CN(C)[Si](C)(C)C1CCCC1.Cl[Zr+2]Cl.[CH3-].[CH3-]
InChIInChI=1S/2C9H21NSi.2CH3.2ClH.Zr/c2*1-10(2)11(3,4)9-7-5-6-8-9;;;;;/h2*9H,5-8H2,1-4H3;2*1H3;2*1H;/q;;2*-1;;;+4/p-2
InChIKeyWNLHDIGUGKRQOW-UHFFFAOYSA-L
MW534.92 g/mol
LogP7.67
Rot. Bonds4

About carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)

carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+) (PubChem CID 162293186) has the molecular formula C20H48Cl2N2Si2Zr and a molecular weight of 534.92 g/mol. Its IUPAC name is carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+).

Molecular Properties

Compound Namecarbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)
PubChem CID162293186
Molecular FormulaC20H48Cl2N2Si2Zr
Molecular Weight534.92 g/mol
Exact Mass532.18
IUPAC Namecarbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)
SMILESCN(C)[Si](C)(C)C1CCCC1.CN(C)[Si](C)(C)C1CCCC1.Cl[Zr+2]Cl.[CH3-].[CH3-]
InChIInChI=1S/2C9H21NSi.2CH3.2ClH.Zr/c2*1-10(2)11(3,4)9-7-5-6-8-9;;;;;/h2*9H,5-8H2,1-4H3;2*1H3;2*1H;/q;;2*-1;;;+4/p-2
InChIKeyWNLHDIGUGKRQOW-UHFFFAOYSA-L
XLogP7.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500534.92
LogP ≤ 57.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[cyclopentyl(dimethyl)silyl]-N-methylhydroxylamine
CID 58554804
N-[cyclohexyl-cyclopentyl-(dimethylamino)silyl]-N-methylmethanamine
CID 139769704
chloro(tricyclopentyl)silane
CID 19891337
cyclooctyl-dimethyl-propan-2-ylsilane
CID 70177611
cobalt;cyclooctane;cyclooctyl(trimethyl)silane
CID 57373058
bis(trimethylsilyl)methyl-cyclohexyl-dimethylsilane
CID 5249242
1-cyclopentylethoxy-(dichloromethyl)-dimethylsilane
CID 554784
tricyclohexyl(trimethylsilyl)silane
CID 139629055
[amino(dimethyl)silyl]cyclododecane
CID 67884963
bromo-cyclohexyl-dimethylsilane
CID 140692715
bis(2,3,3a,4,4a,5,6,7,8,8a,9,9a-dodecahydro-1H-cyclopenta[b]naphthalen-3-yl)-dimethylsilane;carbanide;dichlorozirconium(2+)
CID 162297844
tert-butyl-cyclopentyl-dimethylsilane
CID 58570155

Frequently Asked Questions

What is the IUPAC name of carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)?
The IUPAC name of carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+) (CID 162293186) is carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+).
What is the SMILES notation for carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)?
The canonical SMILES for carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+) is CN(C)[Si](C)(C)C1CCCC1.CN(C)[Si](C)(C)C1CCCC1.Cl[Zr+2]Cl.[CH3-].[CH3-].
What is the InChIKey of carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)?
The InChIKey is WNLHDIGUGKRQOW-UHFFFAOYSA-L. The full InChI is InChI=1S/2C9H21NSi.2CH3.2ClH.Zr/c2*1-10(2)11(3,4)9-7-5-6-8-9;;;;;/h2*9H,5-8H2,1-4H3;2*1H3;2*1H;/q;;2*-1;;;+4/p-2.
What are the key properties of carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+)?
carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+) has a molecular weight of 534.92 g/mol, XLogP of 7.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(N-[cyclopentyl(dimethyl)silyl]-N-methylmethanamine);dichlorozirconium(2+) is sourced from PubChem (CID 162293186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).