3-(tributylstannylmethoxymethoxy)propan-1-amine

C17H39NO2Sn — CID 175081278

IUPAC3-(tributylstannylmethoxymethoxy)propan-1-amine
SMILESCCCC[Sn](CCCC)(CCCC)COCOCCCN
InChIInChI=1S/C5H12NO2.3C4H9.Sn/c1-7-5-8-4-2-3-6;3*1-3-4-2;/h1-6H2;3*1,3-4H2,2H3;
InChIKeyZLJGEFKSTPAEOB-UHFFFAOYSA-N
MW408.22 g/mol
LogP4.71
Rot. Bonds16

About 3-(tributylstannylmethoxymethoxy)propan-1-amine

3-(tributylstannylmethoxymethoxy)propan-1-amine (PubChem CID 175081278) has the molecular formula C17H39NO2Sn and a molecular weight of 408.22 g/mol. Its IUPAC name is 3-(tributylstannylmethoxymethoxy)propan-1-amine.

Molecular Properties

Compound Name3-(tributylstannylmethoxymethoxy)propan-1-amine
PubChem CID175081278
Molecular FormulaC17H39NO2Sn
Molecular Weight408.22 g/mol
Exact Mass409.20
IUPAC Name3-(tributylstannylmethoxymethoxy)propan-1-amine
SMILESCCCC[Sn](CCCC)(CCCC)COCOCCCN
InChIInChI=1S/C5H12NO2.3C4H9.Sn/c1-7-5-8-4-2-3-6;3*1-3-4-2;/h1-6H2;3*1,3-4H2,2H3;
InChIKeyZLJGEFKSTPAEOB-UHFFFAOYSA-N
XLogP4.71
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.22
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(propoxymethoxy)propan-1-amine
CID 87914264
tributyl(methoxymethoxymethyl)stannane
CID 4193592
3-(15-dodecoxypentadecoxy)propan-1-amine
CID 87645067
3-[4-(2-butoxyethoxy)butoxy]propan-1-amine
CID 118457159
3-(propylperoxymethoxy)propan-1-amine
CID 170060757
(2S)-1-(tributylstannylmethoxy)propan-2-amine
CID 91667243
3-dodecoxypropan-1-amine;hydrobromide
CID 173075424
4-nonoxybutan-1-amine
CID 139664551
3-(3-aminopropoxy)propan-1-amine;ethane
CID 23031033
N-[3-[2-[2-(3-aminopropoxy)ethoxy]ethoxy]propyl]pentan-1-amine
CID 175309381
tetrabutylstannane
CID 160899301
6-[2-[2-(2-butoxyethoxy)ethoxy]ethoxy]hexan-1-amine
CID 104566998

Frequently Asked Questions

What is the IUPAC name of 3-(tributylstannylmethoxymethoxy)propan-1-amine?
The IUPAC name of 3-(tributylstannylmethoxymethoxy)propan-1-amine (CID 175081278) is 3-(tributylstannylmethoxymethoxy)propan-1-amine.
What is the SMILES notation for 3-(tributylstannylmethoxymethoxy)propan-1-amine?
The canonical SMILES for 3-(tributylstannylmethoxymethoxy)propan-1-amine is CCCC[Sn](CCCC)(CCCC)COCOCCCN.
What is the InChIKey of 3-(tributylstannylmethoxymethoxy)propan-1-amine?
The InChIKey is ZLJGEFKSTPAEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12NO2.3C4H9.Sn/c1-7-5-8-4-2-3-6;3*1-3-4-2;/h1-6H2;3*1,3-4H2,2H3;.
What are the key properties of 3-(tributylstannylmethoxymethoxy)propan-1-amine?
3-(tributylstannylmethoxymethoxy)propan-1-amine has a molecular weight of 408.22 g/mol, XLogP of 4.71, 16 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tributylstannylmethoxymethoxy)propan-1-amine is sourced from PubChem (CID 175081278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).