N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine

C20H27NSi — CID 140798535

IUPACN-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine
SMILESC=C(c1ccccc1)c1ccc([Si](C)(C)N(CC)CC)cc1
InChIInChI=1S/C20H27NSi/c1-6-21(7-2)22(4,5)20-15-13-19(14-16-20)17(3)18-11-9-8-10-12-18/h8-16H,3,6-7H2,1-2,4-5H3
InChIKeySLTHUCKATREWRT-UHFFFAOYSA-N
MW309.53 g/mol
LogP4.50
Rot. Bonds6

About N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine

N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine (PubChem CID 140798535) has the molecular formula C20H27NSi and a molecular weight of 309.53 g/mol. Its IUPAC name is N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine.

Molecular Properties

Compound NameN-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine
PubChem CID140798535
Molecular FormulaC20H27NSi
Molecular Weight309.53 g/mol
Exact Mass309.19
IUPAC NameN-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine
SMILESC=C(c1ccccc1)c1ccc([Si](C)(C)N(CC)CC)cc1
InChIInChI=1S/C20H27NSi/c1-6-21(7-2)22(4,5)20-15-13-19(14-16-20)17(3)18-11-9-8-10-12-18/h8-16H,3,6-7H2,1-2,4-5H3
InChIKeySLTHUCKATREWRT-UHFFFAOYSA-N
XLogP4.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.53
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine?
The IUPAC name of N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine (CID 140798535) is N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine.
What is the SMILES notation for N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine?
The canonical SMILES for N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine is C=C(c1ccccc1)c1ccc([Si](C)(C)N(CC)CC)cc1.
What is the InChIKey of N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine?
The InChIKey is SLTHUCKATREWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27NSi/c1-6-21(7-2)22(4,5)20-15-13-19(14-16-20)17(3)18-11-9-8-10-12-18/h8-16H,3,6-7H2,1-2,4-5H3.
What are the key properties of N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine?
N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine has a molecular weight of 309.53 g/mol, XLogP of 4.50, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethyl-[4-(1-phenylethenyl)phenyl]silyl]-N-ethylethanamine is sourced from PubChem (CID 140798535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).