3-(2-methylphenyl)imino-1H-indol-2-one

C15H12N2O — CID 135409720

IUPAC3-(2-methylphenyl)imino-1H-indol-2-one
SMILESCc1ccccc1/N=C1\C(=O)Nc2ccccc21
InChIInChI=1S/C15H12N2O/c1-10-6-2-4-8-12(10)16-14-11-7-3-5-9-13(11)17-15(14)18/h2-9H,1H3,(H,16,17,18)
InChIKeyWEYMDCYCTNHOIQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.07
Rot. Bonds1

About 3-(2-methylphenyl)imino-1H-indol-2-one

3-(2-methylphenyl)imino-1H-indol-2-one (PubChem CID 135409720) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-(2-methylphenyl)imino-1H-indol-2-one.

Molecular Properties

Compound Name3-(2-methylphenyl)imino-1H-indol-2-one
PubChem CID135409720
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name3-(2-methylphenyl)imino-1H-indol-2-one
SMILESCc1ccccc1/N=C1\C(=O)Nc2ccccc21
InChIInChI=1S/C15H12N2O/c1-10-6-2-4-8-12(10)16-14-11-7-3-5-9-13(11)17-15(14)18/h2-9H,1H3,(H,16,17,18)
InChIKeyWEYMDCYCTNHOIQ-UHFFFAOYSA-N
XLogP3.07
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylphenyl)imino-1H-indol-2-one?
The IUPAC name of 3-(2-methylphenyl)imino-1H-indol-2-one (CID 135409720) is 3-(2-methylphenyl)imino-1H-indol-2-one.
What is the SMILES notation for 3-(2-methylphenyl)imino-1H-indol-2-one?
The canonical SMILES for 3-(2-methylphenyl)imino-1H-indol-2-one is Cc1ccccc1/N=C1\C(=O)Nc2ccccc21.
What is the InChIKey of 3-(2-methylphenyl)imino-1H-indol-2-one?
The InChIKey is WEYMDCYCTNHOIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-10-6-2-4-8-12(10)16-14-11-7-3-5-9-13(11)17-15(14)18/h2-9H,1H3,(H,16,17,18).
What are the key properties of 3-(2-methylphenyl)imino-1H-indol-2-one?
3-(2-methylphenyl)imino-1H-indol-2-one has a molecular weight of 236.27 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylphenyl)imino-1H-indol-2-one is sourced from PubChem (CID 135409720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).