N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine

C11H28N2Si — CID 123411150

IUPACN-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine
SMILESCCN(CC)CN[SiH2]CCC(C)(C)C
InChIInChI=1S/C11H28N2Si/c1-6-13(7-2)10-12-14-9-8-11(3,4)5/h12H,6-10,14H2,1-5H3
InChIKeyFKYWNQBRSONEJE-UHFFFAOYSA-N
MW216.44 g/mol
LogP1.81
Rot. Bonds7

About N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine

N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine (PubChem CID 123411150) has the molecular formula C11H28N2Si and a molecular weight of 216.44 g/mol. Its IUPAC name is N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine.

Molecular Properties

Compound NameN-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine
PubChem CID123411150
Molecular FormulaC11H28N2Si
Molecular Weight216.44 g/mol
Exact Mass216.20
IUPAC NameN-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine
SMILESCCN(CC)CN[SiH2]CCC(C)(C)C
InChIInChI=1S/C11H28N2Si/c1-6-13(7-2)10-12-14-9-8-11(3,4)5/h12H,6-10,14H2,1-5H3
InChIKeyFKYWNQBRSONEJE-UHFFFAOYSA-N
XLogP1.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine?
The IUPAC name of N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine (CID 123411150) is N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine.
What is the SMILES notation for N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine?
The canonical SMILES for N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine is CCN(CC)CN[SiH2]CCC(C)(C)C.
What is the InChIKey of N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine?
The InChIKey is FKYWNQBRSONEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H28N2Si/c1-6-13(7-2)10-12-14-9-8-11(3,4)5/h12H,6-10,14H2,1-5H3.
What are the key properties of N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine?
N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine has a molecular weight of 216.44 g/mol, XLogP of 1.81, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutylsilyl)-N',N'-diethylmethanediamine is sourced from PubChem (CID 123411150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).