1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone

C15H13NO — CID 105480486

IUPAC1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone
SMILESCC(=O)c1c(C)[nH]c2c1ccc1ccccc12
InChIInChI=1S/C15H13NO/c1-9-14(10(2)17)13-8-7-11-5-3-4-6-12(11)15(13)16-9/h3-8,16H,1-2H3
InChIKeyJLNNGMMTWNAXPB-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.83
Rot. Bonds1

About 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone

1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone (PubChem CID 105480486) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone.

Molecular Properties

Compound Name1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone
PubChem CID105480486
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone
SMILESCC(=O)c1c(C)[nH]c2c1ccc1ccccc12
InChIInChI=1S/C15H13NO/c1-9-14(10(2)17)13-8-7-11-5-3-4-6-12(11)15(13)16-9/h3-8,16H,1-2H3
InChIKeyJLNNGMMTWNAXPB-UHFFFAOYSA-N
XLogP3.83
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone?
The IUPAC name of 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone (CID 105480486) is 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone.
What is the SMILES notation for 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone?
The canonical SMILES for 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone is CC(=O)c1c(C)[nH]c2c1ccc1ccccc12.
What is the InChIKey of 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone?
The InChIKey is JLNNGMMTWNAXPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-9-14(10(2)17)13-8-7-11-5-3-4-6-12(11)15(13)16-9/h3-8,16H,1-2H3.
What are the key properties of 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone?
1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone has a molecular weight of 223.28 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1H-benzo[g]indol-3-yl)ethanone is sourced from PubChem (CID 105480486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).