3-aminopropyltin(3+);tris(propan-2-olate)

C12H29NO3Sn — CID 19359693

IUPAC3-aminopropyltin(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].NCCC[Sn+3]
InChIInChI=1S/C3H8N.3C3H7O.Sn/c1-2-3-4;3*1-3(2)4;/h1-4H2;3*3H,1-2H3;/q;3*-1;+3
InChIKeyQTOAHGZTSKBYFZ-UHFFFAOYSA-N
MW354.08 g/mol
LogP-0.81
Rot. Bonds2

About 3-aminopropyltin(3+);tris(propan-2-olate)

3-aminopropyltin(3+);tris(propan-2-olate) (PubChem CID 19359693) has the molecular formula C12H29NO3Sn and a molecular weight of 354.08 g/mol. Its IUPAC name is 3-aminopropyltin(3+);tris(propan-2-olate).

Molecular Properties

Compound Name3-aminopropyltin(3+);tris(propan-2-olate)
PubChem CID19359693
Molecular FormulaC12H29NO3Sn
Molecular Weight354.08 g/mol
Exact Mass355.12
IUPAC Name3-aminopropyltin(3+);tris(propan-2-olate)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].NCCC[Sn+3]
InChIInChI=1S/C3H8N.3C3H7O.Sn/c1-2-3-4;3*1-3(2)4;/h1-4H2;3*3H,1-2H3;/q;3*-1;+3
InChIKeyQTOAHGZTSKBYFZ-UHFFFAOYSA-N
XLogP-0.81
TPSA95.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.08
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-aminopropyltin(3+);ethanolate
CID 159927858
hexane-1,6-diamine;methanamine
CID 174275715
propane-1,3-diamine;bis(propan-2-ol)
CID 87899449
1-(3-aminopropoxy)ethanol
CID 19915425
bis(propan-2-olate);samarium
CID 162338231
erbium(3+);tris(propan-2-olate)
CID 2734042
pentakis(propan-2-olate);tungsten
CID 173344200
hafnium(4+);bis(propan-2-olate)
CID 22242333
molybdenum;hexakis(propan-2-olate)
CID 138991740
3-di(propan-2-yl)silylpropan-1-amine
CID 152765596
butan-1-amine;propan-2-ol
CID 174667581
36-methylheptatriacontan-1-amine
CID 134324173

Frequently Asked Questions

What is the IUPAC name of 3-aminopropyltin(3+);tris(propan-2-olate)?
The IUPAC name of 3-aminopropyltin(3+);tris(propan-2-olate) (CID 19359693) is 3-aminopropyltin(3+);tris(propan-2-olate).
What is the SMILES notation for 3-aminopropyltin(3+);tris(propan-2-olate)?
The canonical SMILES for 3-aminopropyltin(3+);tris(propan-2-olate) is CC(C)[O-].CC(C)[O-].CC(C)[O-].NCCC[Sn+3].
What is the InChIKey of 3-aminopropyltin(3+);tris(propan-2-olate)?
The InChIKey is QTOAHGZTSKBYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N.3C3H7O.Sn/c1-2-3-4;3*1-3(2)4;/h1-4H2;3*3H,1-2H3;/q;3*-1;+3.
What are the key properties of 3-aminopropyltin(3+);tris(propan-2-olate)?
3-aminopropyltin(3+);tris(propan-2-olate) has a molecular weight of 354.08 g/mol, XLogP of -0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopropyltin(3+);tris(propan-2-olate) is sourced from PubChem (CID 19359693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).