5H-benzimidazolo[1,2-b]isoquinolin-11-one

C15H10N2O — CID 674157

IUPAC5H-benzimidazolo[1,2-b]isoquinolin-11-one
SMILESO=c1c2ccccc2cc2[nH]c3ccccc3n12
InChIInChI=1S/C15H10N2O/c18-15-11-6-2-1-5-10(11)9-14-16-12-7-3-4-8-13(12)17(14)15/h1-9,16H
InChIKeyQHFYYHVXZTVQPY-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.93
Rot. Bonds

About 5H-benzimidazolo[1,2-b]isoquinolin-11-one

5H-benzimidazolo[1,2-b]isoquinolin-11-one (PubChem CID 674157) has the molecular formula C15H10N2O and a molecular weight of 234.26 g/mol. Its IUPAC name is 5H-benzimidazolo[1,2-b]isoquinolin-11-one.

Molecular Properties

Compound Name5H-benzimidazolo[1,2-b]isoquinolin-11-one
PubChem CID674157
Molecular FormulaC15H10N2O
Molecular Weight234.26 g/mol
Exact Mass234.08
IUPAC Name5H-benzimidazolo[1,2-b]isoquinolin-11-one
SMILESO=c1c2ccccc2cc2[nH]c3ccccc3n12
InChIInChI=1S/C15H10N2O/c18-15-11-6-2-1-5-10(11)9-14-16-12-7-3-4-8-13(12)17(14)15/h1-9,16H
InChIKeyQHFYYHVXZTVQPY-UHFFFAOYSA-N
XLogP2.93
TPSA37.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5H-benzimidazolo[1,2-b]isoquinolin-11-one?
The IUPAC name of 5H-benzimidazolo[1,2-b]isoquinolin-11-one (CID 674157) is 5H-benzimidazolo[1,2-b]isoquinolin-11-one.
What is the SMILES notation for 5H-benzimidazolo[1,2-b]isoquinolin-11-one?
The canonical SMILES for 5H-benzimidazolo[1,2-b]isoquinolin-11-one is O=c1c2ccccc2cc2[nH]c3ccccc3n12.
What is the InChIKey of 5H-benzimidazolo[1,2-b]isoquinolin-11-one?
The InChIKey is QHFYYHVXZTVQPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O/c18-15-11-6-2-1-5-10(11)9-14-16-12-7-3-4-8-13(12)17(14)15/h1-9,16H.
What are the key properties of 5H-benzimidazolo[1,2-b]isoquinolin-11-one?
5H-benzimidazolo[1,2-b]isoquinolin-11-one has a molecular weight of 234.26 g/mol, XLogP of 2.93, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-benzimidazolo[1,2-b]isoquinolin-11-one is sourced from PubChem (CID 674157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).