6-chloro-3-methylindeno[2,1-c]quinolin-7-one

C17H10ClNO — CID 19356118

IUPAC6-chloro-3-methylindeno[2,1-c]quinolin-7-one
SMILESCc1ccc2c3c(c(Cl)nc2c1)C(=O)c1ccccc1-3
InChIInChI=1S/C17H10ClNO/c1-9-6-7-12-13(8-9)19-17(18)15-14(12)10-4-2-3-5-11(10)16(15)20/h2-8H,1H3
InChIKeyPPWOYDLJSYLHRK-UHFFFAOYSA-N
MW279.73 g/mol
LogP4.41
Rot. Bonds

About 6-chloro-3-methylindeno[2,1-c]quinolin-7-one

6-chloro-3-methylindeno[2,1-c]quinolin-7-one (PubChem CID 19356118) has the molecular formula C17H10ClNO and a molecular weight of 279.73 g/mol. Its IUPAC name is 6-chloro-3-methylindeno[2,1-c]quinolin-7-one.

Molecular Properties

Compound Name6-chloro-3-methylindeno[2,1-c]quinolin-7-one
PubChem CID19356118
Molecular FormulaC17H10ClNO
Molecular Weight279.73 g/mol
Exact Mass279.05
IUPAC Name6-chloro-3-methylindeno[2,1-c]quinolin-7-one
SMILESCc1ccc2c3c(c(Cl)nc2c1)C(=O)c1ccccc1-3
InChIInChI=1S/C17H10ClNO/c1-9-6-7-12-13(8-9)19-17(18)15-14(12)10-4-2-3-5-11(10)16(15)20/h2-8H,1H3
InChIKeyPPWOYDLJSYLHRK-UHFFFAOYSA-N
XLogP4.41
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-methylindeno[2,1-c]quinolin-7-one?
The IUPAC name of 6-chloro-3-methylindeno[2,1-c]quinolin-7-one (CID 19356118) is 6-chloro-3-methylindeno[2,1-c]quinolin-7-one.
What is the SMILES notation for 6-chloro-3-methylindeno[2,1-c]quinolin-7-one?
The canonical SMILES for 6-chloro-3-methylindeno[2,1-c]quinolin-7-one is Cc1ccc2c3c(c(Cl)nc2c1)C(=O)c1ccccc1-3.
What is the InChIKey of 6-chloro-3-methylindeno[2,1-c]quinolin-7-one?
The InChIKey is PPWOYDLJSYLHRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10ClNO/c1-9-6-7-12-13(8-9)19-17(18)15-14(12)10-4-2-3-5-11(10)16(15)20/h2-8H,1H3.
What are the key properties of 6-chloro-3-methylindeno[2,1-c]quinolin-7-one?
6-chloro-3-methylindeno[2,1-c]quinolin-7-one has a molecular weight of 279.73 g/mol, XLogP of 4.41, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-methylindeno[2,1-c]quinolin-7-one is sourced from PubChem (CID 19356118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).