3-methyl-2-phenylindeno[1,2-d]imidazol-4-one

C17H12N2O — CID 86059747

IUPAC3-methyl-2-phenylindeno[1,2-d]imidazol-4-one
SMILESCn1c(-c2ccccc2)nc2c1C(=O)c1ccccc1-2
InChIInChI=1S/C17H12N2O/c1-19-15-14(12-9-5-6-10-13(12)16(15)20)18-17(19)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyDIFFUHGWNHDFNJ-UHFFFAOYSA-N
MW260.30 g/mol
LogP3.30
Rot. Bonds1

About 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one

3-methyl-2-phenylindeno[1,2-d]imidazol-4-one (PubChem CID 86059747) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one.

Molecular Properties

Compound Name3-methyl-2-phenylindeno[1,2-d]imidazol-4-one
PubChem CID86059747
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name3-methyl-2-phenylindeno[1,2-d]imidazol-4-one
SMILESCn1c(-c2ccccc2)nc2c1C(=O)c1ccccc1-2
InChIInChI=1S/C17H12N2O/c1-19-15-14(12-9-5-6-10-13(12)16(15)20)18-17(19)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyDIFFUHGWNHDFNJ-UHFFFAOYSA-N
XLogP3.30
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-(2-methylphenyl)-2,5-diphenylimidazole
CID 53243903
1-methyl-2-[4-(1-methyl-4,5-diphenylimidazol-2-yl)phenyl]-4,5-diphenylimidazole
CID 102256803
1-methyl-2,5-diphenylimidazole-4-carbaldehyde
CID 14924912
1-methyl-4-(4-nitrophenyl)-2,5-diphenylimidazole
CID 53243899
1-methyl-2-(2-nitrophenyl)-4,5-diphenylimidazole
CID 91262383
methanol;1-methyl-2-(2-nitrophenyl)-4,5-diphenylimidazole
CID 139060722
5-(3-bromophenyl)-1-methyl-2-(4-methylphenyl)-4-phenylimidazole
CID 122227299
2-(cyclopentylidenemethyl)-3-methylbenzo[f]benzimidazole-4,9-dione
CID 10541659
3-methyl-2-phenyl-5-pyridin-3-ylimidazol-4-amine
CID 55048938
2-(cyclohexylidenemethyl)-3-methylbenzo[f]benzimidazole-4,9-dione
CID 10518737
2-(furan-2-yl)-1-methyl-4,5-diphenylimidazole
CID 15129898
3-acetyl-1-methylbenzo[f]indazole-4,9-dione
CID 101064119

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one?
The IUPAC name of 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one (CID 86059747) is 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one.
What is the SMILES notation for 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one?
The canonical SMILES for 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one is Cn1c(-c2ccccc2)nc2c1C(=O)c1ccccc1-2.
What is the InChIKey of 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one?
The InChIKey is DIFFUHGWNHDFNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c1-19-15-14(12-9-5-6-10-13(12)16(15)20)18-17(19)11-7-3-2-4-8-11/h2-10H,1H3.
What are the key properties of 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one?
3-methyl-2-phenylindeno[1,2-d]imidazol-4-one has a molecular weight of 260.30 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-phenylindeno[1,2-d]imidazol-4-one is sourced from PubChem (CID 86059747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).