(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine

C19H25NO2Si — CID 10687682

IUPAC(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine
SMILESCC/C=N/OCCOc1ccc([Si](C)(C)c2ccccc2)cc1
InChIInChI=1S/C19H25NO2Si/c1-4-14-20-22-16-15-21-17-10-12-19(13-11-17)23(2,3)18-8-6-5-7-9-18/h5-14H,4,15-16H2,1-3H3/b20-14+
InChIKeyABVUDNWSLISDAM-XSFVSMFZSA-N
MW327.50 g/mol
LogP3.30
Rot. Bonds8

About (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine

(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine (PubChem CID 10687682) has the molecular formula C19H25NO2Si and a molecular weight of 327.50 g/mol. Its IUPAC name is (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine.

Molecular Properties

Compound Name(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine
PubChem CID10687682
Molecular FormulaC19H25NO2Si
Molecular Weight327.50 g/mol
Exact Mass327.17
IUPAC Name(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine
SMILESCC/C=N/OCCOc1ccc([Si](C)(C)c2ccccc2)cc1
InChIInChI=1S/C19H25NO2Si/c1-4-14-20-22-16-15-21-17-10-12-19(13-11-17)23(2,3)18-8-6-5-7-9-18/h5-14H,4,15-16H2,1-3H3/b20-14+
InChIKeyABVUDNWSLISDAM-XSFVSMFZSA-N
XLogP3.30
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.50
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(Z)-N-[2-(4-phenoxyphenoxy)ethoxy]propan-1-imine
CID 6438132
(E)-N-(2-phenylethoxy)propan-1-imine
CID 88538979
(E)-N-(pyridin-2-ylmethoxy)propan-1-imine
CID 88538998
butoxybenzene;propanal
CID 174367271
methoxy-methyl-(2-phenoxyethoxy)-phenylsilane
CID 151350623
N-[4-(4-butan-2-yloxyphenoxy)butan-2-yloxy]propan-1-imine
CID 54333436
4-[2-[methyl(diphenyl)silyl]oxyethoxy]benzoic acid
CID 22949908
2-(4-triphenylsilylphenoxy)ethyl 2,2-dimethylbutanoate
CID 156654620
1-phenyl-N-(2-trimethylsilylethoxy)methanimine
CID 86645112
ethyl(triphenyl)silane
CID 5219688
2-phenoxyethylmercury
CID 163598363
azane;propoxybenzene
CID 66667480

Frequently Asked Questions

What is the IUPAC name of (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine?
The IUPAC name of (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine (CID 10687682) is (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine.
What is the SMILES notation for (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine?
The canonical SMILES for (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine is CC/C=N/OCCOc1ccc([Si](C)(C)c2ccccc2)cc1.
What is the InChIKey of (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine?
The InChIKey is ABVUDNWSLISDAM-XSFVSMFZSA-N. The full InChI is InChI=1S/C19H25NO2Si/c1-4-14-20-22-16-15-21-17-10-12-19(13-11-17)23(2,3)18-8-6-5-7-9-18/h5-14H,4,15-16H2,1-3H3/b20-14+.
What are the key properties of (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine?
(E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine has a molecular weight of 327.50 g/mol, XLogP of 3.30, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[2-[4-[dimethyl(phenyl)silyl]phenoxy]ethoxy]propan-1-imine is sourced from PubChem (CID 10687682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).