(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine

C15H33NSn — CID 44631373

IUPAC(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine
SMILESCCN(/C=C(\C(C)C)[Sn](CC)(CC)CC)CC
InChIInChI=1S/C9H18N.3C2H5.Sn/c1-5-10(6-2)8-7-9(3)4;3*1-2;/h8-9H,5-6H2,1-4H3;3*1H2,2H3;
InChIKeyXHIOQFQLAOLCTB-UHFFFAOYSA-N
MW346.15 g/mol
LogP4.92
Rot. Bonds8

About (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine

(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine (PubChem CID 44631373) has the molecular formula C15H33NSn and a molecular weight of 346.15 g/mol. Its IUPAC name is (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine
PubChem CID44631373
Molecular FormulaC15H33NSn
Molecular Weight346.15 g/mol
Exact Mass347.16
IUPAC Name(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine
SMILESCCN(/C=C(\C(C)C)[Sn](CC)(CC)CC)CC
InChIInChI=1S/C9H18N.3C2H5.Sn/c1-5-10(6-2)8-7-9(3)4;3*1-2;/h8-9H,5-6H2,1-4H3;3*1H2,2H3;
InChIKeyXHIOQFQLAOLCTB-UHFFFAOYSA-N
XLogP4.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.15
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine?
The IUPAC name of (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine (CID 44631373) is (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine.
What is the SMILES notation for (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine?
The canonical SMILES for (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine is CCN(/C=C(\C(C)C)[Sn](CC)(CC)CC)CC.
What is the InChIKey of (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine?
The InChIKey is XHIOQFQLAOLCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N.3C2H5.Sn/c1-5-10(6-2)8-7-9(3)4;3*1-2;/h8-9H,5-6H2,1-4H3;3*1H2,2H3;.
What are the key properties of (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine?
(E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine has a molecular weight of 346.15 g/mol, XLogP of 4.92, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-diethyl-3-methyl-2-triethylstannylbut-1-en-1-amine is sourced from PubChem (CID 44631373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).