(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine

C17H37NOSn — CID 138970523

IUPAC(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine
SMILESC=C[C@@H](N)COC[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C5H10NO.3C4H9.Sn/c1-3-5(6)4-7-2;3*1-3-4-2;/h3,5H,1-2,4,6H2;3*1,3-4H2,2H3;/t5-;;;;/m1..../s1
InChIKeyLEMNXDSKPGLBCE-SEUOVDNZSA-N
MW390.20 g/mol
LogP4.90
Rot. Bonds14

About (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine

(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine (PubChem CID 138970523) has the molecular formula C17H37NOSn and a molecular weight of 390.20 g/mol. Its IUPAC name is (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine.

Molecular Properties

Compound Name(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine
PubChem CID138970523
Molecular FormulaC17H37NOSn
Molecular Weight390.20 g/mol
Exact Mass391.19
IUPAC Name(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine
SMILESC=C[C@@H](N)COC[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C5H10NO.3C4H9.Sn/c1-3-5(6)4-7-2;3*1-3-4-2;/h3,5H,1-2,4,6H2;3*1,3-4H2,2H3;/t5-;;;;/m1..../s1
InChIKeyLEMNXDSKPGLBCE-SEUOVDNZSA-N
XLogP4.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.20
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine?
The IUPAC name of (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine (CID 138970523) is (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine.
What is the SMILES notation for (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine?
The canonical SMILES for (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine is C=C[C@@H](N)COC[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine?
The InChIKey is LEMNXDSKPGLBCE-SEUOVDNZSA-N. The full InChI is InChI=1S/C5H10NO.3C4H9.Sn/c1-3-5(6)4-7-2;3*1-3-4-2;/h3,5H,1-2,4,6H2;3*1,3-4H2,2H3;/t5-;;;;/m1..../s1.
What are the key properties of (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine?
(2R)-1-(tributylstannylmethoxy)but-3-en-2-amine has a molecular weight of 390.20 g/mol, XLogP of 4.90, 14 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(tributylstannylmethoxy)but-3-en-2-amine is sourced from PubChem (CID 138970523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).