1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine

C14H32N2OSi — CID 173016958

IUPAC1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine
SMILESC=C([SiH3])C(C)OC(C)(N(CC)CC)N(CC)CC
InChIInChI=1S/C14H32N2OSi/c1-8-15(9-2)14(7,16(10-3)11-4)17-12(5)13(6)18/h12H,6,8-11H2,1-5,7,18H3
InChIKeyOWBPJLZAJZACKV-UHFFFAOYSA-N
MW272.51 g/mol
LogP1.63
Rot. Bonds9

About 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine

1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine (PubChem CID 173016958) has the molecular formula C14H32N2OSi and a molecular weight of 272.51 g/mol. Its IUPAC name is 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine
PubChem CID173016958
Molecular FormulaC14H32N2OSi
Molecular Weight272.51 g/mol
Exact Mass272.23
IUPAC Name1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine
SMILESC=C([SiH3])C(C)OC(C)(N(CC)CC)N(CC)CC
InChIInChI=1S/C14H32N2OSi/c1-8-15(9-2)14(7,16(10-3)11-4)17-12(5)13(6)18/h12H,6,8-11H2,1-5,7,18H3
InChIKeyOWBPJLZAJZACKV-UHFFFAOYSA-N
XLogP1.63
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.51
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine?
The IUPAC name of 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine (CID 173016958) is 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine.
What is the SMILES notation for 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine?
The canonical SMILES for 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine is C=C([SiH3])C(C)OC(C)(N(CC)CC)N(CC)CC.
What is the InChIKey of 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine?
The InChIKey is OWBPJLZAJZACKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2OSi/c1-8-15(9-2)14(7,16(10-3)11-4)17-12(5)13(6)18/h12H,6,8-11H2,1-5,7,18H3.
What are the key properties of 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine?
1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine has a molecular weight of 272.51 g/mol, XLogP of 1.63, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N,1-N',1-N'-tetraethyl-1-(3-silylbut-3-en-2-yloxy)ethane-1,1-diamine is sourced from PubChem (CID 173016958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).