9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one

C16H10ClNO — CID 143168973

IUPAC9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one
SMILESO=c1[nH]c2c(c3ccccc13)Cc1cc(Cl)ccc1-2
InChIInChI=1S/C16H10ClNO/c17-10-5-6-11-9(7-10)8-14-12-3-1-2-4-13(12)16(19)18-15(11)14/h1-7H,8H2,(H,18,19)
InChIKeyOSDNVPCYIIBJGU-UHFFFAOYSA-N
MW267.71 g/mol
LogP3.75
Rot. Bonds

About 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one

9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one (PubChem CID 143168973) has the molecular formula C16H10ClNO and a molecular weight of 267.71 g/mol. Its IUPAC name is 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one.

Molecular Properties

Compound Name9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one
PubChem CID143168973
Molecular FormulaC16H10ClNO
Molecular Weight267.71 g/mol
Exact Mass267.05
IUPAC Name9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one
SMILESO=c1[nH]c2c(c3ccccc13)Cc1cc(Cl)ccc1-2
InChIInChI=1S/C16H10ClNO/c17-10-5-6-11-9(7-10)8-14-12-3-1-2-4-13(12)16(19)18-15(11)14/h1-7H,8H2,(H,18,19)
InChIKeyOSDNVPCYIIBJGU-UHFFFAOYSA-N
XLogP3.75
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.71
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one?
The IUPAC name of 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one (CID 143168973) is 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one.
What is the SMILES notation for 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one?
The canonical SMILES for 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one is O=c1[nH]c2c(c3ccccc13)Cc1cc(Cl)ccc1-2.
What is the InChIKey of 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one?
The InChIKey is OSDNVPCYIIBJGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClNO/c17-10-5-6-11-9(7-10)8-14-12-3-1-2-4-13(12)16(19)18-15(11)14/h1-7H,8H2,(H,18,19).
What are the key properties of 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one?
9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one has a molecular weight of 267.71 g/mol, XLogP of 3.75, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-chloro-6,11-dihydroindeno[1,2-c]isoquinolin-5-one is sourced from PubChem (CID 143168973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).