6-phenyldiazenylchromen-2-one

C15H10N2O2 — CID 3827928

IUPAC6-phenyldiazenylchromen-2-one
SMILESO=c1ccc2cc(/N=N/c3ccccc3)ccc2o1
InChIInChI=1S/C15H10N2O2/c18-15-9-6-11-10-13(7-8-14(11)19-15)17-16-12-4-2-1-3-5-12/h1-10H/b17-16+
InChIKeyCNORDUGJKVSSOA-WUKNDPDISA-N
MW250.26 g/mol
LogP4.21
Rot. Bonds2

About 6-phenyldiazenylchromen-2-one

6-phenyldiazenylchromen-2-one (PubChem CID 3827928) has the molecular formula C15H10N2O2 and a molecular weight of 250.26 g/mol. Its IUPAC name is 6-phenyldiazenylchromen-2-one.

Molecular Properties

Compound Name6-phenyldiazenylchromen-2-one
PubChem CID3827928
Molecular FormulaC15H10N2O2
Molecular Weight250.26 g/mol
Exact Mass250.07
IUPAC Name6-phenyldiazenylchromen-2-one
SMILESO=c1ccc2cc(/N=N/c3ccccc3)ccc2o1
InChIInChI=1S/C15H10N2O2/c18-15-9-6-11-10-13(7-8-14(11)19-15)17-16-12-4-2-1-3-5-12/h1-10H/b17-16+
InChIKeyCNORDUGJKVSSOA-WUKNDPDISA-N
XLogP4.21
TPSA54.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.26
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-phenyldiazenylchromen-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-Amino-1,2-benzopyrone
CID 46153
3-(3-aminophenyl)-2H-chromen-2-one
CID 720985
3-(4-aminophenyl)-2H-chromen-2-one
CID 310860
6-Amino-3-phenyl-2H-chromen-2-one
CID 617017
6-Acetamidocoumarin
CID 13262
5-Iodo-6-amino-1,2-benzopyrone
CID 72356
6-Nitro-2-benzopyrone
CID 75944
6-Nitroso-1,2-benzopyrone
CID 1871
(2E)-N-(2-oxo-2H-chromen-6-yl)-3-phenylprop-2-enamide
CID 938899
N-(6-Amino-2-oxo-2H-chromen-3-yl)acetamide
CID 338232
6-Amino-2H-1-benzopyran-2-one--hydrogen chloride (1/1)
CID 356789
4-Azidocoumarin
CID 375228

Frequently Asked Questions

What is the IUPAC name of 6-phenyldiazenylchromen-2-one?
The IUPAC name of 6-phenyldiazenylchromen-2-one (CID 3827928) is 6-phenyldiazenylchromen-2-one.
What is the SMILES notation for 6-phenyldiazenylchromen-2-one?
The canonical SMILES for 6-phenyldiazenylchromen-2-one is O=c1ccc2cc(/N=N/c3ccccc3)ccc2o1.
What is the InChIKey of 6-phenyldiazenylchromen-2-one?
The InChIKey is CNORDUGJKVSSOA-WUKNDPDISA-N. The full InChI is InChI=1S/C15H10N2O2/c18-15-9-6-11-10-13(7-8-14(11)19-15)17-16-12-4-2-1-3-5-12/h1-10H/b17-16+.
What are the key properties of 6-phenyldiazenylchromen-2-one?
6-phenyldiazenylchromen-2-one has a molecular weight of 250.26 g/mol, XLogP of 4.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-phenyldiazenylchromen-2-one is sourced from PubChem (CID 3827928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).