2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide

C8H21N4O3Sn- — CID 173397231

IUPAC2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide
SMILESCCCC[SnH].NC(CO)(CO)CO.[N-]=[N+]=[N-]
InChIInChI=1S/C4H11NO3.C4H9.N3.Sn.H/c5-4(1-6,2-7)3-8;1-3-4-2;1-3-2;;/h6-8H,1-3,5H2;1,3-4H2,2H3;;;/q;;-1;;
InChIKeyLRAJDYADHPRYIY-UHFFFAOYSA-N
MW339.99 g/mol
LogP-0.37
Rot. Bonds5

About 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide

2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide (PubChem CID 173397231) has the molecular formula C8H21N4O3Sn- and a molecular weight of 339.99 g/mol. Its IUPAC name is 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide.

Molecular Properties

Compound Name2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide
PubChem CID173397231
Molecular FormulaC8H21N4O3Sn-
Molecular Weight339.99 g/mol
Exact Mass341.06
IUPAC Name2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide
SMILESCCCC[SnH].NC(CO)(CO)CO.[N-]=[N+]=[N-]
InChIInChI=1S/C4H11NO3.C4H9.N3.Sn.H/c5-4(1-6,2-7)3-8;1-3-4-2;1-3-2;;/h6-8H,1-3,5H2;1,3-4H2,2H3;;;/q;;-1;;
InChIKeyLRAJDYADHPRYIY-UHFFFAOYSA-N
XLogP-0.37
TPSA145.41 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.99
LogP ≤ 5-0.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

2-amino-2-pentadecylpropane-1,3-diol
CID 10266875
2-amino-2-octadecylpropane-1,3-diol
CID 10712432
2-amino-2-(hydroxymethyl)propane-1,3-diol;1-butylsulfanylbutane;rhodium(3+);trichloride
CID 172999753
butyl-λ2-stannane;dihydrate;hydrochloride
CID 174226611
CID 87493832
CID 87493832
2-amino-2-(hydroxymethyl)propane-1,3-diol;trihydrochloride
CID 19084655
2-amino-2-propylpentadecan-1-ol
CID 87201203
butyl-λ2-stannane;sulfane;tris(2-sulfanylethanol)
CID 173333355
2-amino-2-(hydroxymethyl)propane-1,3-diol;ethylhydrazine
CID 88536885
sodium;pentane;azide
CID 175098930
lithium;2-amino-2-(hydroxymethyl)propane-1,3-diol;hydride
CID 173034607
2-amino-2-(hydroxymethyl)propane-1,3-diol;N,N-dimethylmethanamine;dihydrochloride
CID 175534832

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide?
The IUPAC name of 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide (CID 173397231) is 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide.
What is the SMILES notation for 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide?
The canonical SMILES for 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide is CCCC[SnH].NC(CO)(CO)CO.[N-]=[N+]=[N-].
What is the InChIKey of 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide?
The InChIKey is LRAJDYADHPRYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO3.C4H9.N3.Sn.H/c5-4(1-6,2-7)3-8;1-3-4-2;1-3-2;;/h6-8H,1-3,5H2;1,3-4H2,2H3;;;/q;;-1;;.
What are the key properties of 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide?
2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide has a molecular weight of 339.99 g/mol, XLogP of -0.37, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(hydroxymethyl)propane-1,3-diol;butyl-λ2-stannane;azide is sourced from PubChem (CID 173397231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).