N-(trimethoxysilylmethyl)prop-2-en-1-amine

C7H17NO3Si — CID 71365103

IUPACN-(trimethoxysilylmethyl)prop-2-en-1-amine
SMILESC=CCNC[Si](OC)(OC)OC
InChIInChI=1S/C7H17NO3Si/c1-5-6-8-7-12(9-2,10-3)11-4/h5,8H,1,6-7H2,2-4H3
InChIKeyQCLYMVRMPVAXNG-UHFFFAOYSA-N
MW191.30 g/mol
LogP0.18
Rot. Bonds7

About N-(trimethoxysilylmethyl)prop-2-en-1-amine

N-(trimethoxysilylmethyl)prop-2-en-1-amine (PubChem CID 71365103) has the molecular formula C7H17NO3Si and a molecular weight of 191.30 g/mol. Its IUPAC name is N-(trimethoxysilylmethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-(trimethoxysilylmethyl)prop-2-en-1-amine
PubChem CID71365103
Molecular FormulaC7H17NO3Si
Molecular Weight191.30 g/mol
Exact Mass191.10
IUPAC NameN-(trimethoxysilylmethyl)prop-2-en-1-amine
SMILESC=CCNC[Si](OC)(OC)OC
InChIInChI=1S/C7H17NO3Si/c1-5-6-8-7-12(9-2,10-3)11-4/h5,8H,1,6-7H2,2-4H3
InChIKeyQCLYMVRMPVAXNG-UHFFFAOYSA-N
XLogP0.18
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.30
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(trimethoxysilylmethyl)prop-2-en-1-amine?
The IUPAC name of N-(trimethoxysilylmethyl)prop-2-en-1-amine (CID 71365103) is N-(trimethoxysilylmethyl)prop-2-en-1-amine.
What is the SMILES notation for N-(trimethoxysilylmethyl)prop-2-en-1-amine?
The canonical SMILES for N-(trimethoxysilylmethyl)prop-2-en-1-amine is C=CCNC[Si](OC)(OC)OC.
What is the InChIKey of N-(trimethoxysilylmethyl)prop-2-en-1-amine?
The InChIKey is QCLYMVRMPVAXNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17NO3Si/c1-5-6-8-7-12(9-2,10-3)11-4/h5,8H,1,6-7H2,2-4H3.
What are the key properties of N-(trimethoxysilylmethyl)prop-2-en-1-amine?
N-(trimethoxysilylmethyl)prop-2-en-1-amine has a molecular weight of 191.30 g/mol, XLogP of 0.18, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(trimethoxysilylmethyl)prop-2-en-1-amine is sourced from PubChem (CID 71365103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).