benzo[g]indol-2-one

C12H7NO — CID 140590843

IUPACbenzo[g]indol-2-one
SMILESO=C1C=c2ccc3ccccc3c2=N1
InChIInChI=1S/C12H7NO/c14-11-7-9-6-5-8-3-1-2-4-10(8)12(9)13-11/h1-7H
InChIKeyKXBTULMIMYFPGV-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.78
Rot. Bonds

About benzo[g]indol-2-one

benzo[g]indol-2-one (PubChem CID 140590843) has the molecular formula C12H7NO and a molecular weight of 181.19 g/mol. Its IUPAC name is benzo[g]indol-2-one.

Molecular Properties

Compound Namebenzo[g]indol-2-one
PubChem CID140590843
Molecular FormulaC12H7NO
Molecular Weight181.19 g/mol
Exact Mass181.05
IUPAC Namebenzo[g]indol-2-one
SMILESO=C1C=c2ccc3ccccc3c2=N1
InChIInChI=1S/C12H7NO/c14-11-7-9-6-5-8-3-1-2-4-10(8)12(9)13-11/h1-7H
InChIKeyKXBTULMIMYFPGV-UHFFFAOYSA-N
XLogP0.78
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of benzo[g]indol-2-one?
The IUPAC name of benzo[g]indol-2-one (CID 140590843) is benzo[g]indol-2-one.
What is the SMILES notation for benzo[g]indol-2-one?
The canonical SMILES for benzo[g]indol-2-one is O=C1C=c2ccc3ccccc3c2=N1.
What is the InChIKey of benzo[g]indol-2-one?
The InChIKey is KXBTULMIMYFPGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7NO/c14-11-7-9-6-5-8-3-1-2-4-10(8)12(9)13-11/h1-7H.
What are the key properties of benzo[g]indol-2-one?
benzo[g]indol-2-one has a molecular weight of 181.19 g/mol, XLogP of 0.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[g]indol-2-one is sourced from PubChem (CID 140590843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).