benzoylazanide;samarium

C14H12N2O2Sm-2 — CID 87733393

IUPACbenzoylazanide;samarium
SMILES[NH-]C(=O)c1ccccc1.[NH-]C(=O)c1ccccc1.[Sm]
InChIInChI=1S/2C7H7NO.Sm/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H2,8,9);/p-2
InChIKeyYIAFCZFOAAESAF-UHFFFAOYSA-L
MW390.62 g/mol
LogP3.76
Rot. Bonds2

About benzoylazanide;samarium

benzoylazanide;samarium (PubChem CID 87733393) has the molecular formula C14H12N2O2Sm-2 and a molecular weight of 390.62 g/mol. Its IUPAC name is benzoylazanide;samarium.

Molecular Properties

Compound Namebenzoylazanide;samarium
PubChem CID87733393
Molecular FormulaC14H12N2O2Sm-2
Molecular Weight390.62 g/mol
Exact Mass392.01
IUPAC Namebenzoylazanide;samarium
SMILES[NH-]C(=O)c1ccccc1.[NH-]C(=O)c1ccccc1.[Sm]
InChIInChI=1S/2C7H7NO.Sm/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H2,8,9);/p-2
InChIKeyYIAFCZFOAAESAF-UHFFFAOYSA-L
XLogP3.76
TPSA81.74 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.62
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 67930699
1,2-diphenylethane-1,2-dione bromide
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1,2-diphenylethane-1,2-dione;hydrofluoride
CID 158476796
1,2-diphenylethane-1,2-dione;iron
CID 70488368
1,2-diphenylethane-1,2-dione;sulfane
CID 159672950
diphenylmethanone
CID 3102
diphenylmethanone;gold
CID 174931146
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CID 173089080
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CID 19033779
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Frequently Asked Questions

What is the IUPAC name of benzoylazanide;samarium?
The IUPAC name of benzoylazanide;samarium (CID 87733393) is benzoylazanide;samarium.
What is the SMILES notation for benzoylazanide;samarium?
The canonical SMILES for benzoylazanide;samarium is [NH-]C(=O)c1ccccc1.[NH-]C(=O)c1ccccc1.[Sm].
What is the InChIKey of benzoylazanide;samarium?
The InChIKey is YIAFCZFOAAESAF-UHFFFAOYSA-L. The full InChI is InChI=1S/2C7H7NO.Sm/c2*8-7(9)6-4-2-1-3-5-6;/h2*1-5H,(H2,8,9);/p-2.
What are the key properties of benzoylazanide;samarium?
benzoylazanide;samarium has a molecular weight of 390.62 g/mol, XLogP of 3.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzoylazanide;samarium is sourced from PubChem (CID 87733393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).