7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one

C11H10N2O2 — CID 10397938

IUPAC7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one
SMILESCN/N=C/c1ccc2ccc(=O)oc2c1
InChIInChI=1S/C11H10N2O2/c1-12-13-7-8-2-3-9-4-5-11(14)15-10(9)6-8/h2-7,12H,1H3/b13-7+
InChIKeyLBSSHNOXWXWXRS-NTUHNPAUSA-N
MW202.21 g/mol
LogP1.35
Rot. Bonds2

About 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one

7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one (PubChem CID 10397938) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one.

Molecular Properties

Compound Name7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one
PubChem CID10397938
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one
SMILESCN/N=C/c1ccc2ccc(=O)oc2c1
InChIInChI=1S/C11H10N2O2/c1-12-13-7-8-2-3-9-4-5-11(14)15-10(9)6-8/h2-7,12H,1H3/b13-7+
InChIKeyLBSSHNOXWXWXRS-NTUHNPAUSA-N
XLogP1.35
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 7-[(E)-(methylhydrazinylidene)methyl]chromen-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

Frequently Asked Questions

What is the IUPAC name of 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one?
The IUPAC name of 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one (CID 10397938) is 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one.
What is the SMILES notation for 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one?
The canonical SMILES for 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one is CN/N=C/c1ccc2ccc(=O)oc2c1.
What is the InChIKey of 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one?
The InChIKey is LBSSHNOXWXWXRS-NTUHNPAUSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-12-13-7-8-2-3-9-4-5-11(14)15-10(9)6-8/h2-7,12H,1H3/b13-7+.
What are the key properties of 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one?
7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one has a molecular weight of 202.21 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(E)-(methylhydrazinylidene)methyl]chromen-2-one is sourced from PubChem (CID 10397938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).