1-methyl-3-phenyliminoindol-2-one

C15H12N2O — CID 11218587

IUPAC1-methyl-3-phenyliminoindol-2-one
SMILESCN1C(=O)/C(=N\c2ccccc2)c2ccccc21
InChIInChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)14(15(17)18)16-11-7-3-2-4-8-11/h2-10H,1H3/b16-14-
InChIKeyLUEXNLDVPSVDKD-PEZBUJJGSA-N
MW236.27 g/mol
LogP2.78
Rot. Bonds1

About 1-methyl-3-phenyliminoindol-2-one

1-methyl-3-phenyliminoindol-2-one (PubChem CID 11218587) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 1-methyl-3-phenyliminoindol-2-one.

Molecular Properties

Compound Name1-methyl-3-phenyliminoindol-2-one
PubChem CID11218587
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name1-methyl-3-phenyliminoindol-2-one
SMILESCN1C(=O)/C(=N\c2ccccc2)c2ccccc21
InChIInChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)14(15(17)18)16-11-7-3-2-4-8-11/h2-10H,1H3/b16-14-
InChIKeyLUEXNLDVPSVDKD-PEZBUJJGSA-N
XLogP2.78
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-3-phenyliminoindol-2-one
CID 23936952
ethyl 4-[(1-methyl-2-oxoindol-3-ylidene)amino]benzoate
CID 23820110
1-methyl-3-(2-methylsulfanylphenyl)iminoindol-2-one
CID 17370043
3-methoxyimino-1-methylindol-2-one
CID 2729193
(3Z)-3-(diphenylhydrazinylidene)-1-methylindol-2-one
CID 5387378
1,1,3-trimethyl-3-[(E)-(1-methyl-2-oxoindol-3-ylidene)amino]thiourea
CID 6285963
(NZ)-2-methyl-N-(1-methyl-2-oxoindol-3-ylidene)propane-2-sulfinamide
CID 177490058
1-methyl-3-[(2-oxo-1,2-diphenylethylidene)hydrazinylidene]indol-2-one
CID 2531014
(3E)-1-methyl-3-[(Z)-(4-methylphenyl)methylidenehydrazinylidene]indol-2-one
CID 9214035
1-methyl-3-[1-methyl-3-(1-methyl-2,5-dioxopyrrol-3-yl)-2-oxoindol-3-yl]-4-[(1-methyl-2-oxoindol-3-ylidene)amino]pyrrole-2,5-dione
CID 102528035
3-(4-phenylphenyl)imino-1-thiophen-3-ylindol-2-one
CID 10385124
3-phenylimino-1-[(4-phenylpiperazin-1-yl)methyl]indol-2-one
CID 1254994

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-phenyliminoindol-2-one?
The IUPAC name of 1-methyl-3-phenyliminoindol-2-one (CID 11218587) is 1-methyl-3-phenyliminoindol-2-one.
What is the SMILES notation for 1-methyl-3-phenyliminoindol-2-one?
The canonical SMILES for 1-methyl-3-phenyliminoindol-2-one is CN1C(=O)/C(=N\c2ccccc2)c2ccccc21.
What is the InChIKey of 1-methyl-3-phenyliminoindol-2-one?
The InChIKey is LUEXNLDVPSVDKD-PEZBUJJGSA-N. The full InChI is InChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)14(15(17)18)16-11-7-3-2-4-8-11/h2-10H,1H3/b16-14-.
What are the key properties of 1-methyl-3-phenyliminoindol-2-one?
1-methyl-3-phenyliminoindol-2-one has a molecular weight of 236.27 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-phenyliminoindol-2-one is sourced from PubChem (CID 11218587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).