[(R)-furan-2-yl(phenyl)methyl]azanium

C11H12NO+ — CID 6945147

IUPAC[(R)-furan-2-yl(phenyl)methyl]azanium
SMILES[NH3+][C@H](c1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2/p+1/t11-/m1/s1
InChIKeyPUJSAEOHZQWRLE-LLVKDONJSA-O
MW174.22 g/mol
LogP1.61
Rot. Bonds2

About [(R)-furan-2-yl(phenyl)methyl]azanium

[(R)-furan-2-yl(phenyl)methyl]azanium (PubChem CID 6945147) has the molecular formula C11H12NO+ and a molecular weight of 174.22 g/mol. Its IUPAC name is [(R)-furan-2-yl(phenyl)methyl]azanium.

Molecular Properties

Compound Name[(R)-furan-2-yl(phenyl)methyl]azanium
PubChem CID6945147
Molecular FormulaC11H12NO+
Molecular Weight174.22 g/mol
Exact Mass174.09
IUPAC Name[(R)-furan-2-yl(phenyl)methyl]azanium
SMILES[NH3+][C@H](c1ccccc1)c1ccco1
InChIInChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2/p+1/t11-/m1/s1
InChIKeyPUJSAEOHZQWRLE-LLVKDONJSA-O
XLogP1.61
TPSA40.78 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[iodo(phenyl)methyl]furan
CID 139520003
1-(furan-2-yl)-2,2-diphenylethanol
CID 63947549
(1R)-N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 81351264
N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 43177136
2-(2,2-dimethoxy-1-phenylethyl)furan
CID 101093381
(1R)-1-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]ethanamine
CID 81402613
(2R,3R)-3-(furan-2-yl)-3-hydroxy-2-phenylpropanoic acid
CID 3088964
(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile
CID 11818553
1-(furan-2-yl)-2-phenylbutan-1-ol
CID 115797511
2-benzhydrylfuran;ethyl formate
CID 174588492
N-[furan-2-yl(phenyl)methyl]-3-methylpentan-2-amine
CID 60780727
[furan-2-yl(phenyl)methyl]urea
CID 14906081

Frequently Asked Questions

What is the IUPAC name of [(R)-furan-2-yl(phenyl)methyl]azanium?
The IUPAC name of [(R)-furan-2-yl(phenyl)methyl]azanium (CID 6945147) is [(R)-furan-2-yl(phenyl)methyl]azanium.
What is the SMILES notation for [(R)-furan-2-yl(phenyl)methyl]azanium?
The canonical SMILES for [(R)-furan-2-yl(phenyl)methyl]azanium is [NH3+][C@H](c1ccccc1)c1ccco1.
What is the InChIKey of [(R)-furan-2-yl(phenyl)methyl]azanium?
The InChIKey is PUJSAEOHZQWRLE-LLVKDONJSA-O. The full InChI is InChI=1S/C11H11NO/c12-11(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8,11H,12H2/p+1/t11-/m1/s1.
What are the key properties of [(R)-furan-2-yl(phenyl)methyl]azanium?
[(R)-furan-2-yl(phenyl)methyl]azanium has a molecular weight of 174.22 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(R)-furan-2-yl(phenyl)methyl]azanium is sourced from PubChem (CID 6945147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).