N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride

C19H27Cl2NSiTi — CID 173026390

IUPACN-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride
SMILESCC(C)(C)N[Si](C)(C)c1cccc2c1Cc1ccccc1-2.Cl.Cl.[Ti]
InChIInChI=1S/C19H25NSi.2ClH.Ti/c1-19(2,3)20-21(4,5)18-12-8-11-16-15-10-7-6-9-14(15)13-17(16)18;;;/h6-12,20H,13H2,1-5H3;2*1H;
InChIKeyMISZHIISJWZJTK-UHFFFAOYSA-N
MW416.29 g/mol
LogP4.90
Rot. Bonds2

About N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride

N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride (PubChem CID 173026390) has the molecular formula C19H27Cl2NSiTi and a molecular weight of 416.29 g/mol. Its IUPAC name is N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride.

Molecular Properties

Compound NameN-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride
PubChem CID173026390
Molecular FormulaC19H27Cl2NSiTi
Molecular Weight416.29 g/mol
Exact Mass415.08
IUPAC NameN-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride
SMILESCC(C)(C)N[Si](C)(C)c1cccc2c1Cc1ccccc1-2.Cl.Cl.[Ti]
InChIInChI=1S/C19H25NSi.2ClH.Ti/c1-19(2,3)20-21(4,5)18-12-8-11-16-15-10-7-6-9-14(15)13-17(16)18;;;/h6-12,20H,13H2,1-5H3;2*1H;
InChIKeyMISZHIISJWZJTK-UHFFFAOYSA-N
XLogP4.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.29
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

9H-fluoren-1-yl-tri(propan-2-yl)silane
CID 162150347
1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane
CID 22623348
N-[9H-fluoren-1-yl(dimethyl)silyl]dodecan-2-amine
CID 87342848
N-[1,2-dichloro-1-(9H-fluoren-1-yl)ethyl]-2-methylpropan-2-amine
CID 87185294
1-[2-(9H-fluoren-1-yl)but-3-yn-2-yl]-9H-fluorene
CID 151464335
N-ethyl-9H-fluoren-1-amine
CID 67613408
1-N,2-N-ditert-butyl-9H-fluorene-1,2-diamine
CID 151812419
ethenyl-[ethenyl-bis(9H-fluoren-1-yl)silyl]oxy-bis(9H-fluoren-1-yl)silane
CID 151898213
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
CID 123562270
CID 123562270
bis(9H-fluoren-1-yl)-dimethylgermane
CID 22068853

Frequently Asked Questions

What is the IUPAC name of N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride?
The IUPAC name of N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride (CID 173026390) is N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride.
What is the SMILES notation for N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride?
The canonical SMILES for N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride is CC(C)(C)N[Si](C)(C)c1cccc2c1Cc1ccccc1-2.Cl.Cl.[Ti].
What is the InChIKey of N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride?
The InChIKey is MISZHIISJWZJTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NSi.2ClH.Ti/c1-19(2,3)20-21(4,5)18-12-8-11-16-15-10-7-6-9-14(15)13-17(16)18;;;/h6-12,20H,13H2,1-5H3;2*1H;.
What are the key properties of N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride?
N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride has a molecular weight of 416.29 g/mol, XLogP of 4.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[9H-fluoren-1-yl(dimethyl)silyl]-2-methylpropan-2-amine;titanium;dihydrochloride is sourced from PubChem (CID 173026390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).