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

C8H19NO3Si — CID 87211217

IUPACN-(2-trimethoxysilylethyl)prop-2-en-1-amine
SMILESC=CCNCC[Si](OC)(OC)OC
InChIInChI=1S/C8H19NO3Si/c1-5-6-9-7-8-13(10-2,11-3)12-4/h5,9H,1,6-8H2,2-4H3
InChIKeyRQRHQJCGIDRPNK-UHFFFAOYSA-N
MW205.33 g/mol
LogP0.64
Rot. Bonds8

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

N-(2-trimethoxysilylethyl)prop-2-en-1-amine (PubChem CID 87211217) has the molecular formula C8H19NO3Si and a molecular weight of 205.33 g/mol. Its IUPAC name is N-(2-trimethoxysilylethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-(2-trimethoxysilylethyl)prop-2-en-1-amine
PubChem CID87211217
Molecular FormulaC8H19NO3Si
Molecular Weight205.33 g/mol
Exact Mass205.11
IUPAC NameN-(2-trimethoxysilylethyl)prop-2-en-1-amine
SMILESC=CCNCC[Si](OC)(OC)OC
InChIInChI=1S/C8H19NO3Si/c1-5-6-9-7-8-13(10-2,11-3)12-4/h5,9H,1,6-8H2,2-4H3
InChIKeyRQRHQJCGIDRPNK-UHFFFAOYSA-N
XLogP0.64
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.33
LogP ≤ 50.64
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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Related Compounds

N-(trimethoxysilylmethyl)prop-2-en-1-amine
CID 71365103
N-(2-trimethoxysilylethyl)hexan-1-amine
CID 87738268
N,N'-bis(prop-2-enyl)decane-1,10-diamine
CID 118539136
N-benzyl-2-[dimethoxy(prop-2-enoxy)silyl]ethanamine
CID 155679789
N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine
CID 62561595
N-(3-trimethoxysilylpropyl)formamide
CID 14388644
N-[2-[2-[2-(prop-2-enylamino)ethoxy]ethoxy]ethyl]prop-2-en-1-amine
CID 14438303
N'-(2-methoxyethyl)-N'-methyl-N-prop-2-enylethane-1,2-diamine
CID 62557035
N-[2-(3-methoxypropoxy)ethyl]prop-2-en-1-amine
CID 62566842
N-[ethenyl-bis(3-trimethoxysilylpropylamino)silyl]-3-trimethoxysilylpropan-1-amine
CID 71336651
N-prop-2-enyltridecan-1-amine
CID 22467882
ethane;N-prop-2-enylpent-4-en-1-amine
CID 144890480

Frequently Asked Questions

What is the IUPAC name of N-(2-trimethoxysilylethyl)prop-2-en-1-amine?
The IUPAC name of N-(2-trimethoxysilylethyl)prop-2-en-1-amine (CID 87211217) is N-(2-trimethoxysilylethyl)prop-2-en-1-amine.
What is the SMILES notation for N-(2-trimethoxysilylethyl)prop-2-en-1-amine?
The canonical SMILES for N-(2-trimethoxysilylethyl)prop-2-en-1-amine is C=CCNCC[Si](OC)(OC)OC.
What is the InChIKey of N-(2-trimethoxysilylethyl)prop-2-en-1-amine?
The InChIKey is RQRHQJCGIDRPNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO3Si/c1-5-6-9-7-8-13(10-2,11-3)12-4/h5,9H,1,6-8H2,2-4H3.
What are the key properties of N-(2-trimethoxysilylethyl)prop-2-en-1-amine?
N-(2-trimethoxysilylethyl)prop-2-en-1-amine has a molecular weight of 205.33 g/mol, XLogP of 0.64, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-trimethoxysilylethyl)prop-2-en-1-amine is sourced from PubChem (CID 87211217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).