N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine

C11H25NO2Si — CID 156755610

IUPACN,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine
SMILESCN(C)CCC[Si]1(C)OCC(C)(C)CO1
InChIInChI=1S/C11H25NO2Si/c1-11(2)9-13-15(5,14-10-11)8-6-7-12(3)4/h6-10H2,1-5H3
InChIKeyZZGMOIRUPGDKCH-UHFFFAOYSA-N
MW231.41 g/mol
LogP2.08
Rot. Bonds4

About N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine

N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine (PubChem CID 156755610) has the molecular formula C11H25NO2Si and a molecular weight of 231.41 g/mol. Its IUPAC name is N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine
PubChem CID156755610
Molecular FormulaC11H25NO2Si
Molecular Weight231.41 g/mol
Exact Mass231.17
IUPAC NameN,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine
SMILESCN(C)CCC[Si]1(C)OCC(C)(C)CO1
InChIInChI=1S/C11H25NO2Si/c1-11(2)9-13-15(5,14-10-11)8-6-7-12(3)4/h6-10H2,1-5H3
InChIKeyZZGMOIRUPGDKCH-UHFFFAOYSA-N
XLogP2.08
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.41
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine?
The IUPAC name of N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine (CID 156755610) is N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine.
What is the SMILES notation for N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine?
The canonical SMILES for N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine is CN(C)CCC[Si]1(C)OCC(C)(C)CO1.
What is the InChIKey of N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine?
The InChIKey is ZZGMOIRUPGDKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2Si/c1-11(2)9-13-15(5,14-10-11)8-6-7-12(3)4/h6-10H2,1-5H3.
What are the key properties of N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine?
N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine has a molecular weight of 231.41 g/mol, XLogP of 2.08, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2,5,5-trimethyl-1,3,2-dioxasilinan-2-yl)propan-1-amine is sourced from PubChem (CID 156755610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).