N-ethylethanamine;methyl-tris(pent-3-enyl)stannane

C20H41NSn — CID 173454808

IUPACN-ethylethanamine;methyl-tris(pent-3-enyl)stannane
SMILESCC=CCC[Sn](C)(CCC=CC)CCC=CC.CCNCC
InChIInChI=1S/3C5H9.C4H11N.CH3.Sn/c4*1-3-5-4-2;;/h3*4-5H,1,3H2,2H3;5H,3-4H2,1-2H3;1H3;
InChIKeyPUDJKYLTZVKORI-UHFFFAOYSA-N
MW414.27 g/mol
LogP6.58
Rot. Bonds11

About N-ethylethanamine;methyl-tris(pent-3-enyl)stannane

N-ethylethanamine;methyl-tris(pent-3-enyl)stannane (PubChem CID 173454808) has the molecular formula C20H41NSn and a molecular weight of 414.27 g/mol. Its IUPAC name is N-ethylethanamine;methyl-tris(pent-3-enyl)stannane.

Molecular Properties

Compound NameN-ethylethanamine;methyl-tris(pent-3-enyl)stannane
PubChem CID173454808
Molecular FormulaC20H41NSn
Molecular Weight414.27 g/mol
Exact Mass415.23
IUPAC NameN-ethylethanamine;methyl-tris(pent-3-enyl)stannane
SMILESCC=CCC[Sn](C)(CCC=CC)CCC=CC.CCNCC
InChIInChI=1S/3C5H9.C4H11N.CH3.Sn/c4*1-3-5-4-2;;/h3*4-5H,1,3H2,2H3;5H,3-4H2,1-2H3;1H3;
InChIKeyPUDJKYLTZVKORI-UHFFFAOYSA-N
XLogP6.58
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.27
LogP ≤ 56.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(Z)-N-ethylundec-9-en-1-amine
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N-(1,2-13C2)ethyl(1,2-13C2)ethanamine
CID 71309791
(Z)-N-ethylbut-2-en-1-amine;2-methylpropane
CID 171800093
(2E,6Z,10E)-dodeca-2,6,10-triene
CID 12503721
hexatriaconta-2,6,10,14,18,22,26,30,34-nonaene
CID 154144745
(2E,6E,10E,14E,18E,22E)-tetracosa-2,6,10,14,18,22-hexaene
CID 57417215
ethane;(E)-hex-2-ene
CID 142405633
N-ethylethanamine;yttrium
CID 174702634
cerium;N-ethylethanamine
CID 174691303
N-ethylethanamine;λ2-plumbane
CID 174566138

Frequently Asked Questions

What is the IUPAC name of N-ethylethanamine;methyl-tris(pent-3-enyl)stannane?
The IUPAC name of N-ethylethanamine;methyl-tris(pent-3-enyl)stannane (CID 173454808) is N-ethylethanamine;methyl-tris(pent-3-enyl)stannane.
What is the SMILES notation for N-ethylethanamine;methyl-tris(pent-3-enyl)stannane?
The canonical SMILES for N-ethylethanamine;methyl-tris(pent-3-enyl)stannane is CC=CCC[Sn](C)(CCC=CC)CCC=CC.CCNCC.
What is the InChIKey of N-ethylethanamine;methyl-tris(pent-3-enyl)stannane?
The InChIKey is PUDJKYLTZVKORI-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H9.C4H11N.CH3.Sn/c4*1-3-5-4-2;;/h3*4-5H,1,3H2,2H3;5H,3-4H2,1-2H3;1H3;.
What are the key properties of N-ethylethanamine;methyl-tris(pent-3-enyl)stannane?
N-ethylethanamine;methyl-tris(pent-3-enyl)stannane has a molecular weight of 414.27 g/mol, XLogP of 6.58, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylethanamine;methyl-tris(pent-3-enyl)stannane is sourced from PubChem (CID 173454808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).