[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane

C19H35NSi2 — CID 127036015

IUPAC[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane
SMILESCC(Cc1ccc([Si](C)(C)C)cc1)CN1CC[Si](C)(C)CC1
InChIInChI=1S/C19H35NSi2/c1-17(16-20-11-13-22(5,6)14-12-20)15-18-7-9-19(10-8-18)21(2,3)4/h7-10,17H,11-16H2,1-6H3
InChIKeyJCQWKZLNBDZKEG-UHFFFAOYSA-N
MW333.67 g/mol
LogP4.43
Rot. Bonds5

About [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane

[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane (PubChem CID 127036015) has the molecular formula C19H35NSi2 and a molecular weight of 333.67 g/mol. Its IUPAC name is [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane
PubChem CID127036015
Molecular FormulaC19H35NSi2
Molecular Weight333.67 g/mol
Exact Mass333.23
IUPAC Name[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane
SMILESCC(Cc1ccc([Si](C)(C)C)cc1)CN1CC[Si](C)(C)CC1
InChIInChI=1S/C19H35NSi2/c1-17(16-20-11-13-22(5,6)14-12-20)15-18-7-9-19(10-8-18)21(2,3)4/h7-10,17H,11-16H2,1-6H3
InChIKeyJCQWKZLNBDZKEG-UHFFFAOYSA-N
XLogP4.43
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.67
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane?
The IUPAC name of [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane (CID 127036015) is [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane is CC(Cc1ccc([Si](C)(C)C)cc1)CN1CC[Si](C)(C)CC1.
What is the InChIKey of [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane?
The InChIKey is JCQWKZLNBDZKEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NSi2/c1-17(16-20-11-13-22(5,6)14-12-20)15-18-7-9-19(10-8-18)21(2,3)4/h7-10,17H,11-16H2,1-6H3.
What are the key properties of [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane?
[4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane has a molecular weight of 333.67 g/mol, XLogP of 4.43, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(4,4-dimethyl-1,4-azasilinan-1-yl)-2-methylpropyl]phenyl]-trimethylsilane is sourced from PubChem (CID 127036015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).