fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide

C15H14AuFN2O — CID 160906620

IUPACfluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide
SMILESF[Au].[H]/N=C(\N)c1c(O)cccc1C=Cc1ccccc1
InChIInChI=1S/C15H14N2O.Au.FH/c16-15(17)14-12(7-4-8-13(14)18)10-9-11-5-2-1-3-6-11;;/h1-10,18H,(H3,16,17);;1H/q;+1;/p-1
InChIKeySQFOQVKMXZKEHA-UHFFFAOYSA-M
MW454.26 g/mol
LogP3.26
Rot. Bonds3

About fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide

fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide (PubChem CID 160906620) has the molecular formula C15H14AuFN2O and a molecular weight of 454.26 g/mol. Its IUPAC name is fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide.

Molecular Properties

Compound Namefluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide
PubChem CID160906620
Molecular FormulaC15H14AuFN2O
Molecular Weight454.26 g/mol
Exact Mass454.08
IUPAC Namefluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide
SMILESF[Au].[H]/N=C(\N)c1c(O)cccc1C=Cc1ccccc1
InChIInChI=1S/C15H14N2O.Au.FH/c16-15(17)14-12(7-4-8-13(14)18)10-9-11-5-2-1-3-6-11;;/h1-10,18H,(H3,16,17);;1H/q;+1;/p-1
InChIKeySQFOQVKMXZKEHA-UHFFFAOYSA-M
XLogP3.26
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.26
LogP ≤ 53.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide;methanesulfonic acid
CID 158288860
2-chloro-3-(2-phenylethenyl)phenol
CID 70555314
4-[(Z)-2-(4-carbamimidoylphenyl)ethenyl]-3-hydroxybenzenecarboximidamide
CID 135923501
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
2-(2-phenylethenyl)phenol;phosphoric acid
CID 67814298
2-hydroxy-6-methoxybenzenecarboximidamide;hydrochloride
CID 171703209
benzenecarboximidamide;sulfane
CID 172701796
3-(2-phenylethenylsulfonyl)benzenecarboximidamide
CID 57223238
3-[2-(3-bromophenyl)ethenyl]benzenecarboximidamide
CID 141318088
2-methyl-6-[(E)-2-phenylethenyl]phenol
CID 22713146
2-(dimethylamino)-6-[(E)-2-phenylethenyl]phenol
CID 174746341
benzenecarboximidamide;hydron;chloride
CID 66824376

Frequently Asked Questions

What is the IUPAC name of fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide?
The IUPAC name of fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide (CID 160906620) is fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide.
What is the SMILES notation for fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide?
The canonical SMILES for fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide is F[Au].[H]/N=C(\N)c1c(O)cccc1C=Cc1ccccc1.
What is the InChIKey of fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide?
The InChIKey is SQFOQVKMXZKEHA-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H14N2O.Au.FH/c16-15(17)14-12(7-4-8-13(14)18)10-9-11-5-2-1-3-6-11;;/h1-10,18H,(H3,16,17);;1H/q;+1;/p-1.
What are the key properties of fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide?
fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide has a molecular weight of 454.26 g/mol, XLogP of 3.26, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluorogold;2-hydroxy-6-(2-phenylethenyl)benzenecarboximidamide is sourced from PubChem (CID 160906620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).