N-(2-triethoxysilylpropyl)propan-2-imine

C12H27NO3Si — CID 141152918

IUPACN-(2-triethoxysilylpropyl)propan-2-imine
SMILESCCO[Si](OCC)(OCC)C(C)CN=C(C)C
InChIInChI=1S/C12H27NO3Si/c1-7-14-17(15-8-2,16-9-3)12(6)10-13-11(4)5/h12H,7-10H2,1-6H3
InChIKeyRFPQLCNOIFOJOS-UHFFFAOYSA-N
MW261.44 g/mol
LogP2.91
Rot. Bonds9

About N-(2-triethoxysilylpropyl)propan-2-imine

N-(2-triethoxysilylpropyl)propan-2-imine (PubChem CID 141152918) has the molecular formula C12H27NO3Si and a molecular weight of 261.44 g/mol. Its IUPAC name is N-(2-triethoxysilylpropyl)propan-2-imine.

Molecular Properties

Compound NameN-(2-triethoxysilylpropyl)propan-2-imine
PubChem CID141152918
Molecular FormulaC12H27NO3Si
Molecular Weight261.44 g/mol
Exact Mass261.18
IUPAC NameN-(2-triethoxysilylpropyl)propan-2-imine
SMILESCCO[Si](OCC)(OCC)C(C)CN=C(C)C
InChIInChI=1S/C12H27NO3Si/c1-7-14-17(15-8-2,16-9-3)12(6)10-13-11(4)5/h12H,7-10H2,1-6H3
InChIKeyRFPQLCNOIFOJOS-UHFFFAOYSA-N
XLogP2.91
TPSA40.05 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.44
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(2-triethoxysilylpropyl)pentan-2-imine
CID 141498426
N-(2-triethoxysilylpropyl)ethanimine
CID 141202089
N,N-dimethyl-2-triethoxysilylpropan-1-amine
CID 23051840
2-triethoxysilylpropanoate
CID 22068871
4-methyl-N-(3-triethoxysilylhexyl)pentan-2-imine
CID 142452569
4-triethoxysilylpentyl 2-methylprop-2-enoate
CID 87402271
3,3-dimethylbutan-2-yl(triethoxy)silane
CID 91365282
lithium;[bis(triethoxysilyl)methylsulfanyl-triethoxysilylmethyl]-triethoxysilane;hydride
CID 173214345
triethoxy-[1,3,3-tris(triethoxysilyl)propyl]silane
CID 22222937
N'-(2-triethoxysilylpropyl)ethane-1,2-diamine
CID 14875971
triethoxy(5-methyloct-6-en-2-yl)silane
CID 123528408
O-methyl 2-triethoxysilylpropanethioate
CID 141147284

Frequently Asked Questions

What is the IUPAC name of N-(2-triethoxysilylpropyl)propan-2-imine?
The IUPAC name of N-(2-triethoxysilylpropyl)propan-2-imine (CID 141152918) is N-(2-triethoxysilylpropyl)propan-2-imine.
What is the SMILES notation for N-(2-triethoxysilylpropyl)propan-2-imine?
The canonical SMILES for N-(2-triethoxysilylpropyl)propan-2-imine is CCO[Si](OCC)(OCC)C(C)CN=C(C)C.
What is the InChIKey of N-(2-triethoxysilylpropyl)propan-2-imine?
The InChIKey is RFPQLCNOIFOJOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO3Si/c1-7-14-17(15-8-2,16-9-3)12(6)10-13-11(4)5/h12H,7-10H2,1-6H3.
What are the key properties of N-(2-triethoxysilylpropyl)propan-2-imine?
N-(2-triethoxysilylpropyl)propan-2-imine has a molecular weight of 261.44 g/mol, XLogP of 2.91, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-triethoxysilylpropyl)propan-2-imine is sourced from PubChem (CID 141152918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).