N-(3-trimethoxysilylpropyl)aziridin-2-amine

C8H20N2O3Si — CID 58971652

IUPACN-(3-trimethoxysilylpropyl)aziridin-2-amine
SMILESCO[Si](CCCNC1CN1)(OC)OC
InChIInChI=1S/C8H20N2O3Si/c1-11-14(12-2,13-3)6-4-5-9-8-7-10-8/h8-10H,4-7H2,1-3H3
InChIKeyLPCSXOXTGGZCFX-UHFFFAOYSA-N
MW220.34 g/mol
LogP-0.23
Rot. Bonds8

About N-(3-trimethoxysilylpropyl)aziridin-2-amine

N-(3-trimethoxysilylpropyl)aziridin-2-amine (PubChem CID 58971652) has the molecular formula C8H20N2O3Si and a molecular weight of 220.34 g/mol. Its IUPAC name is N-(3-trimethoxysilylpropyl)aziridin-2-amine.

Molecular Properties

Compound NameN-(3-trimethoxysilylpropyl)aziridin-2-amine
PubChem CID58971652
Molecular FormulaC8H20N2O3Si
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC NameN-(3-trimethoxysilylpropyl)aziridin-2-amine
SMILESCO[Si](CCCNC1CN1)(OC)OC
InChIInChI=1S/C8H20N2O3Si/c1-11-14(12-2,13-3)6-4-5-9-8-7-10-8/h8-10H,4-7H2,1-3H3
InChIKeyLPCSXOXTGGZCFX-UHFFFAOYSA-N
XLogP-0.23
TPSA61.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-trimethoxysilylpropyl)aziridin-2-amine?
The IUPAC name of N-(3-trimethoxysilylpropyl)aziridin-2-amine (CID 58971652) is N-(3-trimethoxysilylpropyl)aziridin-2-amine.
What is the SMILES notation for N-(3-trimethoxysilylpropyl)aziridin-2-amine?
The canonical SMILES for N-(3-trimethoxysilylpropyl)aziridin-2-amine is CO[Si](CCCNC1CN1)(OC)OC.
What is the InChIKey of N-(3-trimethoxysilylpropyl)aziridin-2-amine?
The InChIKey is LPCSXOXTGGZCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O3Si/c1-11-14(12-2,13-3)6-4-5-9-8-7-10-8/h8-10H,4-7H2,1-3H3.
What are the key properties of N-(3-trimethoxysilylpropyl)aziridin-2-amine?
N-(3-trimethoxysilylpropyl)aziridin-2-amine has a molecular weight of 220.34 g/mol, XLogP of -0.23, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-trimethoxysilylpropyl)aziridin-2-amine is sourced from PubChem (CID 58971652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).