N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine

C21H45NSiSn — CID 10456842

IUPACN-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine
SMILESC=CCN(CC(=C)[Sn](CCCC)(CCCC)CCCC)[Si](C)(C)C
InChIInChI=1S/C9H18NSi.3C4H9.Sn/c1-6-8-10(9-7-2)11(3,4)5;3*1-3-4-2;/h6H,1-2,8-9H2,3-5H3;3*1,3-4H2,2H3;
InChIKeyTXUSMELOSSKOHP-UHFFFAOYSA-N
MW458.40 g/mol
LogP7.25
Rot. Bonds15

About N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine

N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine (PubChem CID 10456842) has the molecular formula C21H45NSiSn and a molecular weight of 458.40 g/mol. Its IUPAC name is N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine.

Molecular Properties

Compound NameN-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine
PubChem CID10456842
Molecular FormulaC21H45NSiSn
Molecular Weight458.40 g/mol
Exact Mass459.23
IUPAC NameN-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine
SMILESC=CCN(CC(=C)[Sn](CCCC)(CCCC)CCCC)[Si](C)(C)C
InChIInChI=1S/C9H18NSi.3C4H9.Sn/c1-6-8-10(9-7-2)11(3,4)5;3*1-3-4-2;/h6H,1-2,8-9H2,3-5H3;3*1,3-4H2,2H3;
InChIKeyTXUSMELOSSKOHP-UHFFFAOYSA-N
XLogP7.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.40
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine?
The IUPAC name of N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine (CID 10456842) is N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine.
What is the SMILES notation for N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine?
The canonical SMILES for N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine is C=CCN(CC(=C)[Sn](CCCC)(CCCC)CCCC)[Si](C)(C)C.
What is the InChIKey of N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine?
The InChIKey is TXUSMELOSSKOHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18NSi.3C4H9.Sn/c1-6-8-10(9-7-2)11(3,4)5;3*1-3-4-2;/h6H,1-2,8-9H2,3-5H3;3*1,3-4H2,2H3;.
What are the key properties of N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine?
N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine has a molecular weight of 458.40 g/mol, XLogP of 7.25, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-2-tributylstannyl-N-trimethylsilylprop-2-en-1-amine is sourced from PubChem (CID 10456842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).