(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone

C17H12N2OS — CID 138980695

IUPAC(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C17H12N2OS/c20-17(16-11-6-12-21-16)14-9-4-5-10-15(14)19-18-13-7-2-1-3-8-13/h1-12H/b19-18+
InChIKeyHOOJZHTZSRDECJ-VHEBQXMUSA-N
MW292.36 g/mol
LogP5.39
Rot. Bonds4

About (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone

(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone (PubChem CID 138980695) has the molecular formula C17H12N2OS and a molecular weight of 292.36 g/mol. Its IUPAC name is (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone
PubChem CID138980695
Molecular FormulaC17H12N2OS
Molecular Weight292.36 g/mol
Exact Mass292.07
IUPAC Name(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone
SMILESO=C(c1cccs1)c1ccccc1/N=N/c1ccccc1
InChIInChI=1S/C17H12N2OS/c20-17(16-11-6-12-21-16)14-9-4-5-10-15(14)19-18-13-7-2-1-3-8-13/h1-12H/b19-18+
InChIKeyHOOJZHTZSRDECJ-VHEBQXMUSA-N
XLogP5.39
TPSA41.79 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.36
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-phenyldiazenylphenyl)thiophene-2-carboxamide
CID 132506716
oxido-phenyl-[2-(thiophene-2-carbonyl)phenyl]iminoazanium
CID 177458462
2-phenyldiazenylbenzamide
CID 3752866
[3-(thiophene-2-carbonyl)naphthalen-2-yl]-thiophen-2-ylmethanone
CID 5082064
dithiophen-2-ylmethanone;2-thiophen-2-ylthiophene
CID 161486915
2-phenyldiazenylphenol
CID 16897
N-[2-(thiophene-2-carbonyl)phenyl]acetamide
CID 18987253
N-benzyl-2-(thiophene-2-carbonyl)benzamide
CID 11960719
(5-methyl-2-phenylfuran-3-yl)-thiophen-2-ylmethanone
CID 134835171
2-(2-nitrosophenyl)ethyl 2-(thiophene-2-carbonyl)benzoate
CID 89147756
(2-methylthiophen-3-yl)-thiophen-2-ylmethanone
CID 102830577
cyclohexyl-(2-phenyldiazenylphenyl)methanone
CID 134844297

Frequently Asked Questions

What is the IUPAC name of (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone?
The IUPAC name of (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone (CID 138980695) is (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone.
What is the SMILES notation for (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone?
The canonical SMILES for (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone is O=C(c1cccs1)c1ccccc1/N=N/c1ccccc1.
What is the InChIKey of (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone?
The InChIKey is HOOJZHTZSRDECJ-VHEBQXMUSA-N. The full InChI is InChI=1S/C17H12N2OS/c20-17(16-11-6-12-21-16)14-9-4-5-10-15(14)19-18-13-7-2-1-3-8-13/h1-12H/b19-18+.
What are the key properties of (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone?
(2-phenyldiazenylphenyl)-thiophen-2-ylmethanone has a molecular weight of 292.36 g/mol, XLogP of 5.39, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenyldiazenylphenyl)-thiophen-2-ylmethanone is sourced from PubChem (CID 138980695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).