N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine

C13H29NSi — CID 140569005

IUPACN-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine
SMILESCCCC=CC[Si](CC)(CCC)N(C)C
InChIInChI=1S/C13H29NSi/c1-6-9-10-11-13-15(8-3,12-7-2)14(4)5/h10-11H,6-9,12-13H2,1-5H3
InChIKeyGMGOKRUBDMRANX-UHFFFAOYSA-N
MW227.47 g/mol
LogP4.28
Rot. Bonds8

About N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine

N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine (PubChem CID 140569005) has the molecular formula C13H29NSi and a molecular weight of 227.47 g/mol. Its IUPAC name is N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine.

Molecular Properties

Compound NameN-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine
PubChem CID140569005
Molecular FormulaC13H29NSi
Molecular Weight227.47 g/mol
Exact Mass227.21
IUPAC NameN-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine
SMILESCCCC=CC[Si](CC)(CCC)N(C)C
InChIInChI=1S/C13H29NSi/c1-6-9-10-11-13-15(8-3,12-7-2)14(4)5/h10-11H,6-9,12-13H2,1-5H3
InChIKeyGMGOKRUBDMRANX-UHFFFAOYSA-N
XLogP4.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.47
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine?
The IUPAC name of N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine (CID 140569005) is N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine.
What is the SMILES notation for N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine?
The canonical SMILES for N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine is CCCC=CC[Si](CC)(CCC)N(C)C.
What is the InChIKey of N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine?
The InChIKey is GMGOKRUBDMRANX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NSi/c1-6-9-10-11-13-15(8-3,12-7-2)14(4)5/h10-11H,6-9,12-13H2,1-5H3.
What are the key properties of N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine?
N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine has a molecular weight of 227.47 g/mol, XLogP of 4.28, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethyl-hex-2-enyl-propylsilyl)-N-methylmethanamine is sourced from PubChem (CID 140569005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).