(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine

C13H17NO3Sn — CID 134877184

IUPAC(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine
SMILESC[Sn](C)(C)OC(/N=C/c1ccco1)c1ccco1
InChIInChI=1S/C10H8NO3.3CH3.Sn/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8;;;;/h1-7,10H;3*1H3;/q-1;;;;+1/b11-7+;;;;
InChIKeySFPODNXCPCDHCJ-UTUIWUMXSA-N
MW353.99 g/mol
LogP3.84
Rot. Bonds5

About (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine

(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine (PubChem CID 134877184) has the molecular formula C13H17NO3Sn and a molecular weight of 353.99 g/mol. Its IUPAC name is (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine.

Molecular Properties

Compound Name(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine
PubChem CID134877184
Molecular FormulaC13H17NO3Sn
Molecular Weight353.99 g/mol
Exact Mass355.02
IUPAC Name(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine
SMILESC[Sn](C)(C)OC(/N=C/c1ccco1)c1ccco1
InChIInChI=1S/C10H8NO3.3CH3.Sn/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8;;;;/h1-7,10H;3*1H3;/q-1;;;;+1/b11-7+;;;;
InChIKeySFPODNXCPCDHCJ-UTUIWUMXSA-N
XLogP3.84
TPSA47.87 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.99
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine?
The IUPAC name of (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine (CID 134877184) is (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine.
What is the SMILES notation for (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine?
The canonical SMILES for (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine is C[Sn](C)(C)OC(/N=C/c1ccco1)c1ccco1.
What is the InChIKey of (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine?
The InChIKey is SFPODNXCPCDHCJ-UTUIWUMXSA-N. The full InChI is InChI=1S/C10H8NO3.3CH3.Sn/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8;;;;/h1-7,10H;3*1H3;/q-1;;;;+1/b11-7+;;;;.
What are the key properties of (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine?
(E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine has a molecular weight of 353.99 g/mol, XLogP of 3.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(furan-2-yl)-N-[furan-2-yl(trimethylstannyloxy)methyl]methanimine is sourced from PubChem (CID 134877184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).